2979 SMILES Strings for Dihydrofolate reductase

Compound Name
SMILES String
CCC(CC)n1ccc2c1ccc3c2c(nc(n3)N)N
c1ccc(cc1)Sc2cccc3c2c(nc(n3)N)N
Cc1ccc(cc1)Sc2cccc3c2c(nc(n3)N)N
CC(C)(C)c1ccc(cc1)Sc2cccc3c2c(nc(n3)N)N
c1cc2c(c(c1)Sc3ccc(cc3)N4CCOCC4)c(nc(n2)N)N
[H]/N=C(/N/C(=N\[H])/SCc1c(cc(c(c1)C)CS/C(=N/[H])/N/C(=N/[H])/N)C)\N
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
COc1cccc(CSC(=N)NC(N)=N)c1
[H]/N=C(\N)/N/C(=N/[H])/SCc1cccc(c1)C(F)(F)F
NC(=N)NC(=N)SCc1cccc(c1)[N+]([O-])=O
NC(=N)NC(=N)SCc1ccccc1
COc1ccc(CSC(=N)NC(N)=N)cc1
NC(=N)NC(=N)SCc1ccc(Cl)c(Cl)c1
Cc1ccc(CSC(=N)NC(N)=N)cc1
NC(=N)NC(=N)SCc1ccc(cc1)C(F)(F)F
NC(=N)NC(=N)SCc1ccc(Cl)cc1
NC(=N)NC(=N)SCc1ccc(F)cc1
NC(=N)NC(=N)SCc1ccc(cc1)[N+]([O-])=O
NC(=N)NC(=N)SCc1cc(ccc1O)[N+]([O-])=O
NC(=N)NC(=N)SCc1ccccc1C(F)(F)F
NC(=N)NC(=N)SCc1cc(cc(c1)C(F)(F)F)C(F)(F)F
NC(=N)NC(=N)SC\C=C\c1ccccc1
NC(=N)NC(=N)SCc1ccc(Cl)nc1
NC(=N)NC(=N)SCc1cccc(CSC(=N)NC(N)=N)c1
CNC1=C(C(=O)NC(=N1)N)[N+](=O)[O-]
COc1cc(cc(c1OC)OC)Cc2cnc(nc2N)N
COc1cc(c2c(c1OC)O[C@@H](C=C2)C3CC3)Cc4cnc(nc4N)N
COc1cc(Cc2cnc(N)nc2N)c2cc(Cc3c([nH]c4ccc(Cl)cc34)C(=O)N(C)C)oc2c1OC
COc1cc(cc(Cc2cnc(N)nc2N)c1OC)C#CCCCC(O)=O
Cc1c(cnc2c1c(nc(n2)N)N)Cc3cc(ccc3OC)OC
COc1ccc(OCCCC(O)=O)cc1Cc1cnc2nc(N)nc(N)c2c1C
COc1ccc(OCCCCC(O)=O)cc1Cc1cnc2nc(N)nc(N)c2c1C
Cc1c(cnc2c1c(nc(n2)N)N)Cc3cc(ccc3OC)OCCCCCC(=O)O
COc1ccc(OCCCC(O)=O)c(Cc2cnc3nc(N)nc(N)c3c2C)c1
COc1ccc(cc1Cc1cnc2nc(N)nc(N)c2c1C)C#CCCC(O)=O
COc1ccc(cc1Cc1cnc2nc(N)nc(N)c2c1C)C#CCCCC(O)=O
COc1ccc(cc1Cc1cnc2nc(N)nc(N)c2c1C)C#CCCCCC(O)=O
COc1ccc(C#CCCC(O)=O)c(Cc2cnc3nc(N)nc(N)c3c2C)c1
Cc1c(cnc2c1c(nc(n2)N)N)Cc3cc(ccc3C#CCCCC(=O)O)OC
Nc1nc(N)c2nc(CN3c4ccccc4C=Cc4cc(ccc34)C#CCC(O)=O)cnc2n1 |c:17|
Nc1nc(N)c2nc(CN3c4ccccc4C=Cc4cc(ccc34)C#CCCC(O)=O)cnc2n1 |c:17|
Nc1nc(N)c2nc(CN3c4ccccc4C=Cc4cc(ccc34)C#CCCCC(O)=O)cnc2n1 |c:17|
COc1cc(Cc2cnc(N)nc2N)cc(C#CCCC(O)=O)c1Br
CCOC(=O)CCCOc1ccc(c(c1)Cc2cnc3c(c2C)c(nc(n3)N)N)OC
CCOC(=O)CCCCOc1ccc(OC)c(Cc2cnc3nc(N)nc(N)c3c2C)c1
CCOC(=O)CCCCCOc1ccc(c(c1)Cc2cnc3c(c2C)c(nc(n3)N)N)OC
COc1ccc(OCc2ccccc2)c(Cc2cnc3nc(N)nc(N)c3c2C)c1
CCOC(=O)CCCOc1ccc(OC)cc1Cc1cnc2nc(N)nc(N)c2c1C
COc1ccc(I)cc1Cc1cnc2nc(N)nc(N)c2c1C
COc1ccc(I)c(Cc2cnc3nc(N)nc(N)c3c2C)c1
Cc1c(Sc2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[nH]c2nc(N)nc(N)c12 |r|
CCc1c(Sc2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[nH]c2nc(N)nc(N)c12 |r|
CCc1c(Sc2cccc3ccccc23)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2ccc3ccccc3c2)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2ccc(cc2)[N+]([O-])=O)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2ccc(Br)cc2)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2cccc(Cl)c2)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2ccc(Cl)c(Cl)c2)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2ccc(Cl)cc2Cl)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2ccc(OC)cc2)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2cc(OC)ccc2OC)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2cccc(OC)c2)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2ccccc2)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2cccc3cccnc23)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2c(C)cccc2C)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2ccc(Cl)cc2)[nH]c2nc(N)nc(N)c12
CCc1c(Sc2c(Cl)cccc2Cl)[nH]c2nc(N)nc(N)c12
Cc1c(Sc2ccc3ccccc3c2)[nH]c2nc(N)nc(N)c12
Cc1c(Sc2cccc(Cl)c2)[nH]c2nc(N)nc(N)c12
Cc1c(Sc2ccc(Cl)cc2)[nH]c2nc(N)nc(N)c12
Cc1c(Sc2ccc(Cl)c(Cl)c2)[nH]c2nc(N)nc(N)c12
COc1ccc(Sc2[nH]c3nc(N)nc(N)c3c2C)cc1
COc1ccc(OC)c(Sc2[nH]c3nc(N)nc(N)c3c2C)c1
COc1cc(NCc2ccc3nc(N)nc(N)c3c2C)cc(OC)c1OC
COc1cc(NCc2ccc3nc(N)nc(N)c3c2)c(Br)c(OC)c1OC
Nc1nc(N)c2nc(CNc3ccc4cc(Cl)c(Cl)cc4c3)cnc2n1
Nc1nc(N)c2nc(CNc3ccc4cc(Cl)ccc4c3)cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc2cc(Cl)ccc2c1
Nc1nc(N)c2nc(CNc3ccc4c(Cl)cc(Cl)cc4c3)cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc2c(Cl)cc(Cl)cc2c1
CN(Cc1nc2c(N)nc(N)nc2nc1C)c1ccc2c(Cl)cc(Cl)cc2c1
c1ccc2c(c1)C=Cc3ccccc3N2Cc4cnc5c(n4)c(nc(n5)N)N
COc1cc(CCc2c[nH]c3nc(N)nc(N)c23)cc(OC)c1OC
COc1ccc(I)cc1Cc1cnc(N)nc1N
COc1ccc(cc1Cc1cnc(N)nc1N)C#CCCCCC(O)=O
COc1ccc(cc1Cc2cnc(nc2N)N)OCCCCC(=O)O
COc1ccc(CCCCCC(O)=O)cc1Cc1cnc(N)nc1N
CCc1nc(N)nc(N)c1-c1ccc(Cl)cc1
Nc1nc(N)c2cc3c(ccc4ccccc34)cc2n1
Nc1nc(N)c2c(ccc3c4ccccc4ccc23)n1
Nc1nc(N)c2c(ccc3cc4ccccc4cc23)n1
Oc1ccc(cc1)C1(OC(=O)c2ccc3ccccc3c12)c1ccc(O)cc1
Oc1ccc(cc1)C1(OC(=O)c2c1ccc1ccccc21)c1ccc(O)cc1
Oc1ccc(cc1I)C1(OC(=O)c2ccc3ccccc3c12)c1ccc(O)c(I)c1
Oc1ccc(cc1Br)C1(OC(=O)c2ccc3ccccc3c12)c1ccc(O)c(Br)c1
Oc1c(Br)cc(cc1Br)C1(OC(=O)c2ccc3ccccc3c12)c1cc(Br)c(O)c(Br)c1
CC(C)c1cc(c(C)cc1O)C1(OC(=O)c2ccc3ccccc3c12)c1cc(C(C)C)c(O)cc1C
Oc1ccc(cc1Cl)C1(OC(=O)c2c1ccc1ccccc21)c1ccc(O)c(Cl)c1
Oc1ccc(cc1F)C1(OC(=O)c2c1ccc1ccccc21)c1ccc(O)c(F)c1
Oc1ccc(cc1I)C1(OC(=O)c2cccc3cccc1c23)c1ccc(O)c(I)c1
c1cc2cccc3c2c(c1)C(=O)OC3(c4ccc(c(c4)Cl)O)c5ccc(c(c5)Cl)O
Oc1c(Cl)cc(cc1Cl)C1(OC(=O)c2cccc3cccc1c23)c1cc(Cl)c(O)c(Cl)c1
Oc1ccc(cc1)C1(OC(=O)c2cccc3cccc1c23)c1ccc(O)c(Br)c1
Oc1ccc(cc1Br)C1(OC(=O)c2cccc3cccc1c23)c1ccc(O)c(Br)c1
Oc1c(Br)cc(cc1Br)C1(OC(=O)c2cccc3cccc1c23)c1cc(Br)c(O)c(Br)c1
Oc1ccc(cc1Br)C1(OC(=O)c2cccc3c(Cl)ccc1c23)c1ccc(O)c(Br)c1
Oc1ccc(cc1F)C1(OC(=O)c2cccc3cccc1c23)c1ccc(O)c(F)c1
Oc1ccc(cc1F)C1(OC(=O)c2cccc3c(Cl)ccc1c23)c1ccc(O)c(F)c1
Cc1c(Sc2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[nH]c2nc(N)[nH]c(=O)c12 |r|
Nc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cc2c(=O)[nH]1 |r|
CN(Cc1ccc2nc(C)[nH]c(=O)c2c1)c1ccc(s1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
Nc1nc2[nH]cc(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c2c(=O)[nH]1 |r|
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CCc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CCc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(Cl)c(Cl)c1
CCc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(cc1)[N+]([O-])=O
CCc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(F)cc1
CCc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(Br)cc1
CCc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1cccc(Cl)c1
CCc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1cccc(Br)c1
CCc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1cc(cc(c1)C(F)(F)F)C(F)(F)F
CCc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1c(C)cccc1C
Nc1nc(N)c(c(COCc2ccccc2)n1)-c1ccc(NC(=O)C2CC2)cc1
CCc1nc(N)nc(N)c1-c1ccc(NCc2ccc(cc2)S(C)(=O)=O)cc1
CCc1nc(N)nc(N)c1-c1ccc2n(Cc3ccc(cc3)S(C)(=O)=O)cnc2c1
CCc1nc(N)nc(N)c1-c1ccc2n(Cc3ccc(cc3)S(C)(=O)=O)c(nc2c1)C1CCCC1
CCc1nc(N)nc(N)c1-c1ccc2n(Cc3ccc(cc3)S(C)(=O)=O)c(nc2c1)-c1ccccc1
Nc1nc(N)c(c(COCc2ccccc2)n1)-c1ccc(NCc2ccc(Cl)cc2)cc1
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(cc1)[N+]([O-])=O
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(Cl)c(Cl)c1
Cc1cc2nc(N)[nH]c(=O)c2n1Cc1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
Cc1cc2nc(N)[nH]c(=O)c2n1Cc1ccccc1
Cc1cc2nc(N)[nH]c(=O)c2n1Cc1ccncc1
Cc1cc2nc(N)[nH]c(=O)c2n1Cc1ccc(F)cc1
Cc1cc2nc(N)[nH]c(=O)c2n1Cc1ccc(Cl)cc1
Cc1cc2nc(N)[nH]c(=O)c2n1Cc1ccc(Br)cc1
Cc1cc2nc(N)[nH]c(=O)c2n1Cc1ccc(cc1)[N+]([O-])=O
COc1ccc(Cn2c(C)cc3nc(N)[nH]c(=O)c23)cc1
Cc1cc2nc(N)[nH]c(=O)c2n1Cc1ccc(OC(F)(F)F)cc1
Cc1cc2nc(N)[nH]c(=O)c2n1Cc1cc(Cl)cc(Cl)c1
Cc1cc2nc(N)[nH]c(=O)c2n1Cc1cc(Br)cc(Br)c1
Cc1cc2nc(N)[nH]c(=O)c2n1Cc1ccc(Cl)c(Cl)c1
COc1cc(cc(OC)c1OC)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1ccccc1)C(C)C#Cc1c(C)nc(N)nc1N
COc1cc(cc(c1)-c1ccccc1C)C(C)C#Cc1c(C)nc(N)nc1N
COc1cc(cc(c1)-c1c(C)cccc1C)C(C)C#Cc1c(C)nc(N)nc1N
COc1cc(cc(c1)-c1c(cccc1C(C)C)C(C)C)C(C)C#Cc1c(C)nc(N)nc1N
COc1cc(ccc1-c1ccccc1)C(C)C#Cc1c(C)nc(N)nc1N
COc1cc(ccc1-c1ccccc1C)C(C)C#Cc1c(C)nc(N)nc1N
COc1cc(ccc1-c1c(C)cccc1C)C(C)C#Cc1c(C)nc(N)nc1N |(.48,.72,;1.82,1.49,;1.82,3.03,;.49,3.8,;.49,5.34,;1.82,6.11,;3.15,5.34,;3.15,3.8,;4.49,3.03,;4.49,1.49,;3.15,.72,;5.82,.72,;7.15,1.49,;7.15,3.03,;5.82,3.8,;5.82,5.34,;-.85,6.11,;-.85,7.65,;-2.18,5.34,;-3.52,4.57,;-4.85,3.8,;-4.85,2.26,;-3.52,1.49,;-6.18,1.49,;-7.52,2.26,;-8.85,1.49,;-7.52,3.8,;-6.18,4.57,;-6.18,6.11,)|
COc1cc(ccc1-c1c(cccc1C(C)C)C(C)C)C(C)C#Cc1c(C)nc(N)nc1N |(.48,.72,;1.82,1.49,;1.82,3.03,;.49,3.8,;.49,5.34,;1.82,6.11,;3.15,5.34,;3.15,3.8,;4.49,3.03,;5.82,3.8,;7.15,3.03,;7.15,1.49,;5.82,.72,;4.49,1.49,;3.4,.4,;3.4,-1.14,;1.86,.4,;5.82,5.34,;7.15,6.11,;4.49,6.11,;-.85,6.11,;-.85,7.65,;-2.18,5.34,;-3.52,4.57,;-4.85,3.8,;-4.85,2.26,;-3.52,1.49,;-6.18,1.49,;-7.52,2.26,;-8.85,1.49,;-7.52,3.8,;-6.18,4.57,;-6.18,6.11,)|
COc1cc(cc(c1)-c1ccccc1)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1ccccc1)[C@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(CC#Cc2cnc(N)nc2N)cc(OC)c1OC
COc1cc(CC#Cc2c(C)nc(N)nc2N)cc(OC)c1OC
COc1cc(cc(OC)c1OC)C(C)C#Cc1cnc(N)nc1N
COc1cc(cc(OC)c1OC)C(O)C#Cc1cnc(N)nc1N
COC(C#Cc1cnc(N)nc1N)c1cc(OC)c(OC)c(OC)c1
COc1cc(cc(OC)c1OC)C(C)C#Cc1c(C)nc(N)nc1N
Cc1c(c(nc(n1)N)N)C#C[C@@H](c2cc(c(c(c2)OC)OC)OC)O
Cc1c(c(nc(n1)N)N)C#C[C@H](c2cc(c(c(c2)OC)OC)OC)OC
COc1ccc(OC)c(CC#Cc2cnc(N)nc2N)c1
COc1ccc(OC)c(CC#Cc2c(C)nc(N)nc2N)c1
CCc1c(c(nc(n1)N)N)C#CCc2cc(ccc2OC)OC
CCCc1c(c(nc(n1)N)N)C#CCc2cc(ccc2OC)OC
CCc1c(c(nc(n1)N)N)C#CCc2cc(c(c(c2)OC)OC)OC
CCc1nc(N)nc(N)c1C#CCc1cccc(OC)c1OC
CCc1nc(N)nc(N)c1C#CCc1ccccc1
Cc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1ccccc1
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(Cl)cc1
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(cc1)[N+]([O-])=O
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1cc(OC)ccc1OC
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(Cl)c(Cl)c1
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1cc(Cl)cc(Cl)c1
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc2ccccc2c1
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1ccncc1
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(F)cc1
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(Br)cc1
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1cccc(Cl)c1
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1cc(OC)cc(OC)c1
CCc1sc2nc(N)[nH]c(=O)c2c1Sc1ccccc1Cl
C/C(=C\c1coc2c1c(nc(n2)N)N)/c3ccccc3OC
C/C(=C/c1coc2c1c(nc(n2)N)N)/c3ccccc3OC
CCC\C(=C\c1coc2nc(N)nc(N)c12)c1ccccc1OC
CC(C)/C(=C/c1coc2c1c(nc(n2)N)N)/c3ccccc3OC
COc1ccccc1\C(=C/c1coc2nc(N)nc(N)c12)C1CC1
CCCC\C(=C\c1coc2nc(N)nc(N)c12)c1ccccc1OC
COc1ccccc1\C(CC(C)C)=C/c1coc2nc(N)nc(N)c12
CCC(C)C(=C\c1coc2nc(N)nc(N)c12)\c1ccccc1OC
CCCC(Cc1coc2nc(N)nc(N)c12)c1ccccc1OC
COc1ccccc1C(Cc1coc2nc(N)nc(N)c12)C(C)C
COc1ccccc1C(Cc1coc2nc(N)nc(N)c12)C1CC1
CCCCC(Cc1coc2nc(N)nc(N)c12)c1ccccc1OC
COc1ccccc1C(CC(C)C)Cc1coc2nc(N)nc(N)c12
CCC(C)C(Cc1coc2nc(N)nc(N)c12)c1ccccc1OC
CC1Cc2nc(N)nc(N)c2CC1C
C[C@H]1CCc2c(c(nc(n2)N)N)C1
Cc1ccc(Oc2cccc3nc(N)nc(N)c23)cc1
Nc1nc(N)c2c(Oc3ccc(F)cc3)cccc2n1
c1cc2c(c(c1)Sc3ccc(cc3)Cl)c(nc(n2)N)N
Cc1cc(cc(c1)c2cc(cc(c2)OC)[C@@H](C)C#Cc3c(nc(nc3N)N)C)C
Cc1ccc(cc1)c2cc(cc(c2)OC)[C@@H](C)C#Cc3c(nc(nc3N)N)C
COc1cc(cc(c1)-c1ccc(cc1)C(C)(C)C)C(C)C#Cc1c(C)nc(N)nc1N
COc1ccc(cc1)-c1cc(OC)cc(c1)C(C)C#Cc1c(C)nc(N)nc1N
Cc1c(c(nc(n1)N)N)C#CC(C)(C)c2cc(c(c(c2)OC)OC)OC
CC[C@@H](C#Cc1c(nc(nc1N)N)C)c2cc(c(c(c2)OC)OC)OC
NC1=NC2(CCCC2)N(Cc2ccccc2)C(N)=N1 |c:19,t:1|
NC1=NC2(CCCC2)N(OCc2ccccc2)C(N)=N1 |c:20,t:1|
NC1=NC2(CCCC2)N(OCCc2ccccc2)C(N)=N1 |c:21,t:1|
NC1=NC2(CCCC2)N(OCCCc2ccccc2)C(N)=N1 |c:22,t:1|
NC1=NC2(CCCC2)N(OCCCOc2ccccc2)C(N)=N1 |c:23,t:1|
CN(CCCON1C(N)=NC(N)=NC11CCCC1)c1ccccc1 |c:8,11|
NC1=NC2(CCCC2)N(OCCCCOc2ccccc2)C(N)=N1 |c:24,t:1|
NC1=NC2(CCCCC2)N(Cc2ccccc2)C(N)=N1 |c:20,t:1|
NC1=NC2(CCCCC2)N(OCc2ccccc2)C(N)=N1 |c:21,t:1|
NC1=NC2(CCCCC2)N(OCCc2ccccc2)C(N)=N1 |c:22,t:1|
NC1=NC2(CCCCC2)N(OCCCc2ccccc2)C(N)=N1 |c:23,t:1|
NC1=NC2(CCCCC2)N(OCCCOc2ccccc2)C(N)=N1 |c:24,t:1|
CN(CCCON1C(N)=NC(N)=NC11CCCCC1)c1ccccc1 |c:8,11|
NC1=NC2(CCCCC2)N(OCCCCOc2ccccc2)C(N)=N1 |c:25,t:1|
COc1ccccc1-c1ccc2c(N)nc(N)nc2c1
Nc1nc(N)c2ccc(cc2n1)-c1ccccc1N
COc1ccc(OC)c(c1)-c1ccc2c(N)nc(N)nc2c1
Nc1ccc(cc1)-c1ccc2c(N)nc(N)nc2c1
Cc1cc2c(N)nc(N)nc2cc1-c1ccc(N)cc1
CC(=O)c1cccc(c1)-c1ccc2c(N)nc(N)nc2c1
CC(=O)c1cccc(c1)-c1cc2nc(N)nc(N)c2cc1C
COc1ccc(CO)cc1-c1cc2nc(N)nc(N)c2cc1C
Cc1cc2c(N)nc(N)nc2cc1-c1cccc2[nH]ccc12
Nc1nc(N)c2cc(Cn3ccnc3)c(cc2n1)-c1ccc(CO)c(CO)c1
Cc1cc2c(N)nc(N)nc2cc1-c1cccc(c1)[N+]#[C-]
Cc1cc2c(N)nc(N)nc2cc1-c1cc(N)cc(c1)[N+]#[C-]
Cc1cc2c(N)nc(N)nc2cc1-c1cccc(C[N+]#[C-])c1
Cc1cc2nc(-c3ccc4c(N)nc(N)nc4c3)n(CCCO)c2cc1C
Cc1cc2nc(C3CC3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2nc(-c3ccccn3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2nc(-c3ccco3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2nc(-c3cccs3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2nc(N3CCOCC3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
COc1ccc2nc(SCCC(C)(F)F)n(-c3ccc4c(N)nc(N)nc4c3)c2c1
Cc1cc2nc(-c3ccsc3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2nc(-c3nccs3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
COc1cc2n(c(nc2cc1CO)-c1nccs1)-c1cc2nc(N)nc(N)c2cc1Cl |(1.28,-3.4,;-.18,-3.87,;-1.33,-2.84,;-1.01,-1.34,;-2.15,-.31,;-2.15,1.23,;-3.62,1.71,;-4.52,.46,;-3.62,-.78,;-3.94,-2.29,;-2.79,-3.32,;-3.11,-4.82,;-1.97,-5.85,;-4.39,3.04,;-3.48,4.29,;-4.39,5.54,;-5.85,5.06,;-5.85,3.52,;-.82,2,;.52,1.23,;1.85,2,;3.18,1.23,;4.52,2,;5.85,1.23,;4.52,3.54,;3.18,4.31,;3.18,5.85,;1.85,3.54,;.52,4.31,;-.82,3.54,;-2.15,4.31,)|
COc1cc2n(c(nc2cc1CO)-c1nccs1)-c1cc2nc(N)nc(N)c2cc1C |(1.28,-3.4,;-.18,-3.87,;-1.33,-2.84,;-1.01,-1.34,;-2.15,-.31,;-2.15,1.23,;-3.62,1.71,;-4.52,.46,;-3.62,-.78,;-3.94,-2.29,;-2.79,-3.32,;-3.11,-4.82,;-1.97,-5.85,;-4.39,3.04,;-3.48,4.29,;-4.39,5.54,;-5.85,5.06,;-5.85,3.52,;-.82,2,;.52,1.23,;1.85,2,;3.18,1.23,;4.52,2,;5.85,1.23,;4.52,3.54,;3.18,4.31,;3.18,5.85,;1.85,3.54,;.52,4.31,;-.82,3.54,;-2.15,4.31,)|
Cc1cc2nc(-c3nccs3)n(-c3cc4nc(N)nc(N)c4cc3Cl)c2cc1C |(17.33,-13.36,;17.81,-11.9,;16.79,-10.75,;17.27,-9.29,;16.5,-7.97,;17.53,-6.82,;17.22,-5.31,;18.26,-4.16,;17.49,-2.82,;15.98,-3.13,;15.81,-4.67,;18.94,-7.45,;20.27,-6.69,;21.61,-7.46,;22.94,-6.68,;24.27,-7.44,;25.61,-6.67,;26.95,-7.44,;25.6,-5.12,;24.26,-4.36,;24.26,-2.82,;22.94,-5.13,;21.6,-4.37,;20.27,-5.14,;19.49,-3.8,;18.78,-8.98,;19.8,-10.12,;19.32,-11.58,;20.35,-12.72,)|
Cc1cc2nc(-c3nccs3)n(-c3cc4nc(N)nc(N)c4cc3C)c2cc1C |(2.23,-13.87,;2.71,-12.41,;1.68,-11.26,;2.16,-9.8,;1.4,-8.48,;2.43,-7.33,;2.11,-5.82,;3.16,-4.67,;2.39,-3.33,;.87,-3.65,;.71,-5.19,;3.83,-7.96,;5.17,-7.2,;6.5,-7.97,;7.83,-7.19,;9.17,-7.96,;10.5,-7.18,;11.84,-7.95,;10.5,-5.63,;9.16,-4.87,;9.15,-3.33,;7.83,-5.65,;6.5,-4.88,;5.17,-5.65,;4.4,-4.32,;3.67,-9.49,;4.69,-10.63,;4.22,-12.09,;5.25,-13.24,)|
Cc1cc2c(N)nc(N)nc2cc1-c1cnc2[nH]ccc2c1
Cc1cc2c(N)nc(N)nc2cc1-c1cc(CO)ncc1Cl
COc1nc(CO)ncc1-c1cc2nc(N)nc(N)c2cc1C
CCOc1ccc(cc1-c1ccc2c(N)nc(N)nc2c1)-c1cccc(NS(C)(=O)=O)c1
CCOc1ccc2ccccc2c1-c1cc2nc(N)nc(N)c2cc1C |(2,-3.46,;.66,-2.69,;-.67,-3.47,;-2,-2.7,;-3.33,-3.47,;-4.68,-2.7,;-4.67,-1.16,;-6,-.39,;-6,1.14,;-4.66,1.91,;-3.34,1.14,;-3.34,-.39,;-2.01,-1.16,;-.68,-.39,;.66,-1.17,;1.99,-.39,;3.33,-1.15,;4.66,-.38,;6,-1.14,;4.65,1.17,;3.32,1.93,;3.31,3.47,;1.99,1.16,;.66,1.92,;-.67,1.15,;-2.01,1.92,)|
COC(=O)c1ccc2n(c(nc2c1)-c1nccs1)-c1ccc2c(N)nc(N)nc2c1
COc1cc(cc(OC)c1OC)-c1cc2nc(N)nc(N)c2cc1C
COc1cc2n(c(nc2cc1CO)-c1nccs1)-c1ccc2c(N)nc(N)nc2c1
Cc1ccc2n(c(nc2c1)-c1cccs1)-c1ccc2c(N)nc(N)nc2c1
COc1ccc2nc(-c3ccco3)n(-c3ccc4c(N)nc(N)nc4c3)c2n1
COc1cnc(Cl)cc1-c1cc2nc(N)nc(N)c2cc1C
Cc1c(nc(-c2cccs2)n1-c1ccc2c(N)nc(N)nc2c1)C(=O)OC(C)(C)C
CCOc1ccc(cc1-c1cc2nc(N)nc(N)c2cc1C)C(=O)N(CC)CC
Cc1cc2c(N)nc(N)nc2cc1-c1c[nH]c2ccccc12
CCc1c(c(nc(n1)N)N)C#CCc2cc(ccc2OC)c3ccccc3
CCc1nc(N)nc(N)c1C#CCc1cccc(c1)-c1ccccc1
CCc1c(c(nc(n1)N)N)C#CCc2cc(cc(c2)OC)c3ccccc3
COc1ccc(cc1C(C)C#Cc1c(C)nc(N)nc1N)-c1ccccc1
CCc1nc(N)nc(N)c1C#CC(C)c1cc(ccc1OC)-c1ccccc1
COc1cc(cc(c1)-c1ccncc1)C(C)C#Cc1c(C)nc(N)nc1N
CCc1c(c(nc(n1)N)N)C#C[C@H](C)c2cc(cc(c2)OC)c3ccncc3
CCc1nc(N)nc(N)c1C#CCc1cc(ccc1OC)-c1ccncc1
CCc1nc(N)nc(N)c1C#CCc1cc(OC)cc(c1)-c1ccncc1
CCc1nc(N)nc(N)c1C#CCc1cccc(c1)-c1ccncc1
COc1cc(cc(c1)N1CCOCC1)C(C)C#Cc1c(C)nc(N)nc1N
CCc1nc(N)nc(N)c1C#CCc1cccc(c1)-c1cccnc1
CCc1nc(N)nc(N)c1C#CCc1cccc(c1)-c1cncnc1
Cc1c(c(nc(n1)N)N)C#C[C@H](C)c2ccc(cc2OC)c3ccccc3
COc1cc(ccc1C(C)C#Cc1c(C)nc(N)nc1N)-c1ccccc1C
COc1cc(ccc1C(C)C#Cc1c(C)nc(N)nc1N)-c1c(C)cccc1C
COc1cc(ccc1C(C)C#Cc1c(C)nc(N)nc1N)-c1c(cccc1C(C)C)C(C)C
Nc1nc(N)c2NC(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CCc2n1
Nc1nc(N)c2N(C=O)C(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CCc2n1
Nc1nc(N)c2N(CC=C)C(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CCc2n1
Nc1nc(N)c2N(CC(Br)CBr)C(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CCc2n1
Nc1nc(O)c2NC(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CCc2n1 |r|
Nc1nc(O)c2N(C=O)C(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CCc2n1
Nc1nc(O)c2N(CC=C)C(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CCc2n1
Nc1nc(N)c2N(C=O)C(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CCc2n1 |r|
CCc1nc(N)nc(N)c1C#CCc1cc(OC)c(OC)c(c1)-c1ccncc1
CCc1nc(N)nc(N)c1C#C[C@@H](C)c1cc(ccc1OC)-c1ccc(cc1)C(O)=O |r|
CCc1nc(N)nc(N)c1C#C[C@@H](C)c1cc(OC)cc(c1)-c1ccc(cc1)C(O)=O |r|
CCc1nc(N)nc(N)c1C#C[C@H](C)c1cc(OC)cc(c1)-c1ccc(cc1)C(O)=O |r|
CCc1nc(N)nc(N)c1C#CCc1cc(OC)cc(c1)-c1ccc(cc1)C(O)=O
CCc1nc(N)nc(N)c1C#CC(C)c1cc2OCOc2c(c1)-c1ccc(cc1)C(O)=O
CCc1nc(N)nc(N)c1C#C[C@@H](C)c1cc2OCOc2c(c1)-c1ccc(cc1)C(O)=O |r|
CCc1nc(N)nc(N)c1C#C[C@H](C)c1cc2OCOc2c(c1)-c1ccc(cc1)C(O)=O |r|
COc1ccc(cc1)-n1c(=S)[nH]c2ccc(Cl)cc2c1=O
COc1ccc(cc1)-n1c(=S)[nH]c2cc(OC)c(OC)cc2c1=O
CCOC(=O)CSc1nc2ccc(Cl)cc2c(=O)n1-c1ccc(OC)cc1
CCOC(=O)CSc1nc2cc(OC)c(OC)cc2c(=O)n1-c1ccc(OC)cc1
COc1ccc(cc1)-n1c(SCC(=O)NN)nc2ccc(Cl)cc2c1=O
COc1ccc(cc1)-n1c(SCC(=O)NN)nc2cc(OC)c(OC)cc2c1=O
COc1ccc(cc1)-n1c(SCC(=O)N\N=C\c2ccc(Cl)cc2)nc2ccc(Cl)cc2c1=O
COc1ccc(\C=N\NC(=O)CSc2nc3ccc(Cl)cc3c(=O)n2-c2ccc(OC)cc2)cc1
COc1ccc(cc1)-n1c(SCC(=O)N\N=C\c2ccc(Cl)cc2)nc2cc(OC)c(OC)cc2c1=O
COc1ccc(\C=N\NC(=O)CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccc(OC)cc2)cc1
COc1ccc(cc1)-n1c(SCC(=O)NNC(=S)c2ccc(Cl)cc2)nc2ccc(Cl)cc2c1=O
COc1ccc(cc1)-n1c(SCC(=O)NNC(=S)c2ccc(Cl)cc2)nc2cc(OC)c(OC)cc2c1=O
COc1ccc(cc1)C(=S)NNC(=O)CSc1nc2cc(OC)c(OC)cc2c(=O)n1-c1ccc(OC)cc1
COc1ccc(cc1)-n1c(SCc2nnc(S)n2-c2ccc(Cl)cc2)nc2cc(OC)c(OC)cc2c1=O
COc1ccc(cc1)-n1c(S)nnc1CSc1nc2cc(OC)c(OC)cc2c(=O)n1-c1ccc(OC)cc1
COc1ccc(cc1)-n1c(SCc2nnc(Nc3ccc(Cl)cc3)s2)nc2ccc(Cl)cc2c1=O
COc1ccc(Nc2nnc(CSc3nc4ccc(Cl)cc4c(=O)n3-c3ccc(OC)cc3)s2)cc1
COc1ccc(cc1)-n1c(SCc2nnc(Nc3ccc(Cl)cc3)s2)nc2cc(OC)c(OC)cc2c1=O
COc1ccc(Nc2nnc(CSc3nc4cc(OC)c(OC)cc4c(=O)n3-c3ccc(OC)cc3)s2)cc1
NC(=N)NC(=N)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1
NC(=N)NC(=N)Nc1ccc(OCCCN2C(=O)c3ccccc3C2=O)cc1
NC(=N)NC(=N)Nc1ccc(OCCCCN2C(=O)c3ccccc3C2=O)cc1
CC1(C)N=C(N)N=C(N)N1c1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCCCN2C(=O)c3ccccc3C2=O)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCCCCN2C(=O)c3ccccc3C2=O)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCC(O)CN2C(=O)c3ccccc3C2=O)cc1 |t:3,6|
NC(=N)NC(=N)Nc1ccc(OCc2ccccc2)cc1
NC(=N)NC(=N)Nc1ccc(OCc2cccc(Cl)c2)cc1
NC(=N)NC(=N)Nc1ccc(OCc2ccccc2Cl)cc1
NC(=N)NC(=N)Nc1ccc(OCc2ccc(Cl)cc2Cl)cc1
NC(=N)NC(=N)Nc1ccc(OCc2ccc(Br)cc2)cc1
COc1cccc(COc2ccc(NC(=N)NC(N)=N)cc2)c1
NC(=N)NC(=N)Nc1ccc(OCc2ccc(cc2)-c2ccccc2)cc1
CC1(C)N=C(N)N=C(N)N1c1ccc(OCc2ccccc2)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCc2cccc(Cl)c2)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCc2ccccc2Cl)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCc2ccc(Cl)cc2Cl)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCc2ccc(Br)cc2)cc1 |t:3,6|
COc1ccc(COc2ccc(cc2)N2C(N)=NC(N)=NC2(C)C)cc1 |c:17,20|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCc2ccc(cc2)-c2ccccc2)cc1 |t:3,6|
CCc1nc(N)nc(N)c1C#CCc1cc(ccc1OC)-c1ccccc1C(O)=O
CCc1nc(N)nc(N)c1C#CCc1cc(ccc1OC)-c1ccc(cc1)C(O)=O
CCc1nc(N)nc(N)c1C#CC(SC)c1cc(ccc1OC)-c1ccc(cc1)C(O)=O
CCc1nc(N)nc(N)c1C#CC(C)c1cc2OCOc2c(c1)-c1cncn1C
CCc1nc(N)nc(N)c1C#C[C@H](C)c1cc2OCOc2c(c1)-c1ccncc1 |r|
CCc1nc(N)nc(N)c1C#CCc1cc(ccc1OC)-c1cncn1C
CCc1nc(N)nc(N)c1C#C[C@@H](C)c1cc(ccc1OC)-c1ccncc1 |r|
CCc1nc(N)nc(N)c1C#CC(C)c1cc(OC)cc(c1)-c1ccc(cc1)C(O)=O
CCc1nc(N)nc(N)c1C#CCc1ccc(OC)c(c1)-c1ccc(cc1)C(O)=O
COc1ccc(Sc2sc3nc(N)nc(N)c3c2C)cc1OC
COc1ccccc1Sc1sc2nc(N)nc(N)c2c1C
COc1cccc(Sc2sc3nc(N)nc(N)c3c2C)c1
COc1ccc(Sc2sc3nc(N)nc(N)c3c2C)cc1
COc1ccccc1Sc1c(C)c2c(N)nc(N)nc2n1C
COc1cccc(Sc2c(C)c3c(N)nc(N)nc3n2C)c1
COc1ccc(Sc2c(C)c3c(N)nc(N)nc3n2C)cc1OC
COC(=O)[C@@H]([C@@H]1CCCCN1)c1ccccc1 |r|
COc1cc(C[C@H]2NCCc3cc(O)c(O)cc23)cc(OC)c1OC
Cc1nc(N)nc2ccc(Nc3ccccc3)nc12
Cc1ccc(Nc2ccc3nc(N)nc(C)c3n2)cc1
Cc1nc(N)nc2ccc(Nc3ccc(O)cc3)nc12
COc1ccc(Nc2ccc3nc(N)nc(C)c3n2)cc1
CCc1cccc(Nc2ccc3nc(N)nc(C)c3n2)c1CC
CCc1ccc(Nc2ccc3nc(N)nc(C)c3n2)cc1CC
Cc1nc(N)nc2ccc(Nc3ccc(F)c(F)c3)nc12
Cc1nc(N)nc2ccc(Nc3cc(F)c(F)c(F)c3)nc12
Cc1nc(N)nc2ccc(Nc3ccc(OC(F)(F)F)cc3)nc12
CN(c1ccccc1)c1ccc2nc(N)nc(C)c2n1
CCN(c1ccccc1)c1ccc2nc(N)nc(C)c2n1
CCCN(c1ccccc1)c1ccc2nc(N)nc(C)c2n1
CC(C)N(c1ccccc1)c1ccc2nc(N)nc(C)c2n1
CCCCN(c1ccccc1)c1ccc2nc(N)nc(C)c2n1
CN(c1ccc(OC(F)(F)F)cc1)c1ccc2nc(N)nc(C)c2n1
Cc1cn([C@H]2CC3OP(O)(=O)OCC3O2)c(=O)[nH]c1=O
CC(C)CC(NC(=O)N1CCN(Cc2nc[nH]c2C)C(=O)C1Cc1ccccc1)C(O)=O
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(O)(O)=O)O2)c(=O)[nH]c1=O |r|
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
c1cc(c(cc1N2CCN(CC2)c3cnc(nc3N)N)Cl)Cl
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2ccccc2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(c2)C(F)(F)F)c(N)n1
Nc1ncc(N2CCN(CC2)c2ccccc2)c(N)n1
Nc1ncc(N2CCN(CC2)c2ccc(Cl)cc2)c(N)n1
Cc1cccc(c1)N1CCN(CC1)c1cnc(N)nc1N
Nc1ncc(N2CCN(CC2)c2cccc(Br)c2)c(N)n1
Nc1ncc(N2CCN(CC2)c2ccccc2-c2ccccc2)c(N)n1
Nc1ncc(N2CCC(CC2)c2ccccc2)c(N)n1
Cc1nc(N)nc(N)c1N1CCN(CC1)c1cccc(Cl)c1
Cc1nc(N)nc(N)c1N1CCN(CC1)c1ccccc1
CC1CN(CCN1c1cccc(c1)-c1ccccc1)c1cnc(N)nc1N
CC1CN(CCN1c1cnc(N)nc1N)c1cccc(c1)-c1ccccc1
CCc1nc(N)nc(N)c1N1CCN(CC1)c1ccccc1
CCc1nc(N)nc(N)c1N1CCN(CC1)c1cccc(C)c1
CCc1nc(N)nc(N)c1N1CCN(CC1)c1cccc(OC)c1
CCc1nc(N)nc(N)c1N1CCN(CC1)c1ccccn1
CCc1nc(N)nc(N)c1N1CCN(CC1)c1ccc(F)cc1
CCc1nc(N)nc(N)c1N1CCN(CC1)c1ccncc1
CCCc1c(c(nc(n1)N)N)N2CCN(CC2)c3ccccc3
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2cccc(F)c2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(c2)C2CC2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2cccc(c2)C#N)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2ncccn2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2cnccn2)c(N)n1
Cc1ncc(cn1)-c1cccc(c1)N1CCN(CC1)c1cnc(N)nc1N
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2ccnnc2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2cncnc2)c(N)n1
COc1ncc(cn1)-c1cccc(c1)N1CCN(CC1)c1cnc(N)nc1N
COc1ncccc1-c1cccc(c1)N1CCN(CC1)c1cnc(N)nc1N
CCc1ncc(cn1)-c1cccc(c1)N1CCN(CC1)c1cnc(N)nc1N
Nc1ncc(N2CCN(CC2)c2cccc(c2)C2CCOCC2)c(N)n1
Cc1ncc(cn1)-c1cccc(c1)C1CCN(CC1)c1cnc(N)nc1N
CN(C)c1ncc(cn1)-c1cccc(c1)N1CCN(CC1)c1cnc(N)nc1N
CCCc1nc(N)nc(N)c1N1CCC(CC1)c1ccccc1
CCCc1nc(N)nc(N)c1N1CCN(CC1)c1ccc(F)cc1
CNc1ncc(cn1)-c1cccc(c1)N1CCN(CC1)c1cnc(N)nc1N
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2cnc(nc2)N2CCC2)c(N)n1
CCCc1nc(N)nc(N)c1N1CCN(CC1)c1ccccn1
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2cnc(Cl)nc2)c(N)n1
CCCc1nc(N)nc(N)c1N1CCN(CC1)c1ncc(C)cn1
CCc1nc(N)nc(N)c1N1CCN(CC1)c1ccc(C)cc1
CCCc1nc(N)nc(N)c1N1CCN(CC1)c1ccc(OC)cn1
Nc1ncc(N2CCN(CC2)c2cccc(c2)N2CCOCC2)c(N)n1
CCc1nc(N)nc(N)c1N1CCN(CC1)c1ccc(F)cn1
CCc1nc(N)nc(N)c1N1CCN(CC1)c1ccc(C)cn1
Nc1nc(N)c(N2CCN(CC2)c2ccccc2)c(CC2CC2)n1
Nc1ncc(N2CCN(CC2)c2ccc(nc2)C(F)(F)F)c(N)n1
Cc1ccc(cc1)N1CCN(CC1)c1cnc(N)nc1N
COc1ccc(cc1)N1CCN(CC1)c1cnc(N)nc1N
Nc1ncc(N2CCN(CC2)c2ccc(cc2)C(F)(F)F)c(N)n1
COc1cccc(c1)N1CCN(CC1)c1cnc(N)nc1N
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2ccncn2)c(N)n1
Nc1ncc(N2CCN(CC2)c2ccc(F)cc2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2cnc(nc2)C(F)(F)F)c(N)n1
CCc1ncc(cn1)-c1cccc(c1)C1CCN(CC1)c1cnc(N)nc1N
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2cnc(nc2)C2CC2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cnc3ccccc3c2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2cccnn2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2ccnc(F)c2)c(N)n1
CC1Oc2nc(N)nc(O)c2N=C1C |c:12|
CC1=Nc2c(O)nc(N)nc2OC1c1ccccc1 |t:1|
Nc1nc(O)c2N=C(COc2n1)c1ccccc1 |c:6|
CC1=Nc2c(O)nc(N)nc2OC1 |t:1|
Nc1nc(O)c2N=C(Cc3ccccc3)COc2n1 |t:6|
Nc1nc(O)c2N=C(CCc3ccccc3)COc2n1 |t:6|
Nc1nc(O)c2N=C(CCCc3ccccc3)COc2n1 |t:6|
Nc1nc(O)c2N=C(CCCCc3ccccc3)COc2n1 |t:6|
CCCCCC1=Nc2c(O)nc(N)nc2OC1 |t:5|
CC1Oc2nc(N)nc(N)c2N=C1C |c:12|
Nc1nc(N)c2N=C(COc2n1)c1ccccc1 |c:6|
Cc1n(C)c(C)c2c1cnc1nc(N)[nH]c(=O)c21
Nc1nc2NCC3CN(CC3c2c(=O)[nH]1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc(O)c2c3cn(cc3cnc2n1)-c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc2NCC(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=Nc2c(=O)[nH]1 |c:27|
CCC(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc(N)c2nc(CN(CCCCCC(O)=O)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
CCOC(=O)CCCCCN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)OCC)C(=O)OCC
CCOC(=O)CCCN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)OCC)C(=O)OCC
Nc1nc(N)c2nc(CN(CCCC(O)=O)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
CCOC(=O)CCCCN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)OCC)C(=O)OCC
Nc1nc(N)c2nc(CN(CCCCC(O)=O)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2c3CCC(Cc3cnc2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CCC(Cc1cnc2nc(N)nc(N)c2c1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CC(Cc1cnc2nc(N)nc(N)c2c1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Cc1c(CN(CC#C)c2ccc(cc2)C(=O)NC(CCC(O)=O)C(O)=O)cnc2nc(N)nc(N)c12
Nc1nc(N)c2cc(CN(CC#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
CCC(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CC(=C)C(O)=O)C(O)=O
Nc1nc(N)c2nc(CCc3ccc(cc3)C(=O)NC(CC(=C)C(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CCc3ccc(cc3)C(=O)NC(C(O)CC(O)=O)C(O)=O)cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CC(=C)C(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(C(O)CC(O)=O)C(O)=O
OC(=O)CCC(NC(=O)c1ccc(cc1)N(CC#C)Cc1ccc2nc[nH]c(=O)c2c1)C(O)=O
NCCCC(NC(=O)c1ccc(NCc2cnc3nc(N)nc(N)c3n2)cc1)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCN)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCNCC(O)=O)C(O)=O
NCCCC(NC(=O)c1ccc(NCc2cnc3nc(N)nc(N)c3c2)cc1)C(O)=O
NCCCC(NC(=O)c1ccc(NCc2cnc3nc(N)[nH]c(=O)c3c2)cc1)C(O)=O
NCCCC(NC(=O)c1ccc(NCc2ccc3nc(N)nc(N)c3n2)cc1)C(O)=O
NCCCC(NC(=O)c1ccc(NCc2ccc3nc(N)nc(N)c3c2)cc1)C(O)=O
NCCCC(NC(=O)c1ccc(NCc2ccc3nc(N)[nH]c(=O)c3c2)cc1)C(O)=O
Nc1nc(N)c2c(OCc3ccc(cc3)C(F)(F)F)cccc2n1
Nc1nc(-c2ccc(F)cc2)n(-c2ccc(F)cc2)c(=[NH2+])n1
CCCCCCCc1c(O)c2ccccc2[nH]c1=O
NC(=N)N=C(N)Nc1ccc(Cl)cc1C#N |w:3.2|
Cc1cc(CNC(=[NH2+])CC(N)=S)c(C)cc1CNC(=N)NC(N)=[SH+]
CC1CCC2C(C1)N=C(N)N=C2N |c:11,t:8|
CC1CC2N=C(N)N=C(N)C2CC1C |t:4,7|
OC(=O)CC[C@H](NC(=O)c1ccc(cc1)N(CC#C)Cc1ccc2nc[nH]c(=O)c2c1)C(O)=O
Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cc2c(=O)[nH]1
CC(Cc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O)c1cnc2nc(N)nc(N)c2n1
Nc1nc(N)c2nc(CCc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
CCC(Cc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O)c1cnc2nc(N)nc(N)c2n1
CCC(CC1CNc2nc(N)[nH]c(=O)c2C1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc2CCC(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)Cc2c(=O)[nH]1
CC(CC1CNc2nc(N)[nH]c(=O)c2C1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NCCCC(=O)NC(CCC(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NCCCC(=O)NCCCC(=O)NCCCC(=O)NCCCC(=O)NC(CCC(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NCCCC(=O)NCCCC(=O)NCCCC(=O)NC(CCC(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NCCCC(=O)NCCCC(=O)NC(CCC(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NCCCC(=O)NCCCC(=O)NCCCC(=O)NCCCC(=O)NCCCC(=O)NC(CCC(O)=O)C(O)=O
CCC(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
Nc1nc(N)c2nc(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2n1
Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cc2c(=O)[nH]1
Nc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cc2c(=O)[nH]1
CCN(Cc1ccc2nc[nH]c(=O)c2c1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc2ccc(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cc2c(=O)[nH]1
CCN(Cc1ccc2nc(N)[nH]c(=O)c2c1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
OC(=O)CCC(NC(=O)c1ccc(NCc2ccc3nc[nH]c(=O)c3c2)cc1)C(O)=O
CS(=O)(=O)Oc1ccc(Cc2cnc(N)nc2N)cc1
COc1c(\C=C\C)cc(Cc2cnc(N)nc2N)cc1\C=C\C
CCOc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC
CCCc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC
CCCc1cc(Cc2cnc(N)nc2N)cc(CCC)c1OC
COc1cc(Cc2cnc(N)nc2N)cc(CC=C)c1O
CCCc1cc(Cc2cnc(N)nc2N)cc(CC=C)c1OC
COc1cc(Cc2cnc(N)nc2N)cc(\C=C\C)c1OC
COc1cc(Cc2cnc(N)nc2N)cc(OCC=C)c1OC
CCCOc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC
COc1ccc(cc1Cc1cnc(N)nc1N)C#Cc1ccc(cc1)C(O)=O
COc1cc(cc(c1OC)C#CCCCC(=O)O)Cc2cnc(nc2N)N
COc1cc(Cc2cnc(N)nc2N)cc(C#Cc2ccc(cc2)C(O)=O)c1OC
CNc1ncc(Cc2cc(OC)c(OC)c(OC)c2)c(N)n1
COc1ccc(cc1Cc1cnc(N)nc1N)C#CCCCC(O)=O
COc1cc(Cc2c(N)nc(N)nc2OC)cc(OC)c1OC
CCCc1nc(N)nc(N)c1Cc1cc(OC)c(OC)c(OC)c1
COc1cc(Cc2c(N)nc(N)nc2-c2ccccc2)cc(OC)c1O
COc1cc(Cc2c(C)nc(N)nc2N)cc(OC)c1O
COc1c(cc(Cc2c(N)nc(N)nc2N)cc1C(C)(C)C)C(C)(C)C
CCc1cc(Cc2c(N)nc(N)nc2SC)cc(CC)c1OC
COc1cc(Cc2c(C)nc(N)nc2N)cc(OC)c1OC
COc1cc(Cc2c(N)nc(N)nc2-c2ccccc2)cc(OC)c1OC
COc1cc(Cc2c(N)nc(N)nc2C(C)C)cc(OC)c1OC
COc1cc(Cc2c(N)nc(N)nc2SC)cc(OC)c1OC
COc1cc(Cc2c(N)nc(N)nc2Oc2ccccc2)cc(OC)c1OC
COc1cc(Cc2c(N)nc(N)nc2N)cc(OC)c1OC
Nc1nc(N)c2nc(CCSc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CSc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(COc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CCOc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
CC(C)N(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
COC(=O)CCCCCOc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC
COc1cc(Cc2cnc(N)nc2N)cc(OCCCC(O)=O)c1OC
COc1cc(Cc2cnc(N)nc2N)cc(OCCC(O)=O)c1OC
COc1cc(Cc2cnc(N)nc2N)cc(OCCCCCCC(O)=O)c1OC
COc1cc(Cc2cnc(N)nc2N)cc(OCCCCC(O)=O)c1OC
COC(=O)CCCCCCOc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC
COC(=O)CCCCOc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC
COc1cc(Cc2cnc(N)nc2N)cc(OCCCCCC(O)=O)c1OC
CCOC(=O)CCCOc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC
COC(=O)COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC
COc1cc(Cc2cnc(N)nc2N)cc(OCC(O)=O)c1OC
CC(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CC(C)(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CCCCOc1cccc(Cc2cnc(N)nc2N)c1
CCCCCCOc1cccc(Cc2cnc(N)nc2N)c1
Nc1nc2ccc(CN(CC#N)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cc2c(=O)[nH]1
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1Br
COc1cc(Cc2cnc(N)nc2N)cc(OCCCNCCC(O)=O)c1Br
CCCCCCCCOC(=O)CCC(NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(O)=O
CCCCCCCCCCCCCCCCOC(=O)C(CCC(O)=O)NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1
CCCCCCCCCCCCOC(=O)C(CCC(O)=O)NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1
CCCCCCCCOC(=O)C(CCC(O)=O)NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1
CCCCOC(=O)C(CCC(O)=O)NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1
CCCCCCCCCCCCCCCCOC(=O)CCC(NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(O)=O
CCCCOC(=O)CCC(NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(O)=O
CCCCCCCCCCCCOC(=O)CCC(NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(O)=O
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OCC(O)=O
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OCCCC(O)=O
COC(=O)CCCCCOc1c(OC)cc(Cc2cnc(N)nc2N)cc1OC
COC(=O)CCCCOc1c(OC)cc(Cc2cnc(N)nc2N)cc1OC
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OCCCCC(O)=O
CCOC(=O)CCCOc1c(OC)cc(Cc2cnc(N)nc2N)cc1OC
CCOC(=O)COc1c(OC)cc(Cc2cnc(N)nc2N)cc1OC
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OCCCCCC(O)=O
CC[C@@H](Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CC[C@H](CC1CNc2nc(N)nc(N)c2N1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CC[C@@H](CC1=Nc2c(N)nc(N)nc2NC1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r,t:4|
C[C@H](Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
Cc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
Nc1ncnc2ncc(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)nc12
CN(CC1CCc2nc(N)[nH]c(=O)c2C1)c1ccc(cc1)C(O)=O
Nc1nc2CCC(CNc3ccc(cc3)C(O)=O)Cc2c(=O)[nH]1
Nc1nc2CCC(CN(CC#C)c3ccc(cc3)C(O)=O)Cc2c(=O)[nH]1
CN(CC1CCc2nc(N)[nH]c(=O)c2C1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc2CCC(CN(CC#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)Cc2c(=O)[nH]1
NC(=O)c1ccc[n+](c1)[C@H]1O[C@@H](COP([O-])(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](OP(O)(O)=O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@H](O)[C@@H]1O |r|
Cc1nc2nc(N)nc(N)c2nc1C
Nc1nc2NCC(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)Nc2c(=O)[nH]1
Nc1nc2ncc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)nc2c(=O)[nH]1 |r|
Cc1c(CCc2ccc(cc2)C(=O)NC(CCC(O)=O)C(O)=O)cnc2nc(N)nc(N)c12
CCC1C(CCc2ccc(cc2)C(=O)NC(CCC(O)=O)C(O)=O)CNc2nc(N)[nH]c(=O)c12
CC1C(CCc2ccc(cc2)C(=O)NC(CCC(O)=O)C(O)=O)CNc2nc(N)[nH]c(=O)c12
Cc1c(CCc2ccc(cc2)C(=O)NC(CCC(O)=O)C(O)=O)cnc2nc(N)[nH]c(=O)c12
Nc1ncc(Cc2cccc(c2)C(F)(F)F)c(N)n1
Nc1ncc(Cc2ccc(O)c(O)c2)c(N)n1
Nc1ncc(Cc2ccc(OC(F)(F)F)cc2)c(N)n1
Nc1ncc(Cc2ccc3OCOc3c2)c(N)n1
Nc1ncc(Cc2cccc(F)c2)c(N)n1
COCCOc1cccc(Cc2cnc(N)nc2N)c1
Nc1ncc(Cc2cccc(Cl)c2)c(N)n1
Cc1ccc(Cc2cnc(N)nc2N)cc1
CCCCOc1ccc(Cc2cnc(N)nc2N)cc1
Nc1ncc(Cc2ccc(OCc3ccccc3)cc2)c(N)n1
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1N(C)C
CCc1cc(Cc2cnc(N)nc2N)cc(CC)c1CC
CCCCOCc1cccc(Cc2cnc(N)nc2N)c1
CCCCCCCCOc1cc(Cc2cnc(N)nc2N)ccc1OC
NC(=O)COc1cccc(Cc2cnc(N)nc2N)c1
Cc1cccc(Cc2cnc(N)nc2N)c1
Nc1ncc(Cc2ccc(O)cc2)c(N)n1
COc1ccc(Cc2cnc(N)nc2N)cc1OS(C)(=O)=O
Nc1ncc(Cc2ccc(Br)cc2)c(N)n1
CN(C)c1ccc(Cc2cnc(N)nc2N)cc1
Nc1ncc(Cc2cccc(CO)c2)c(N)n1
CCCCCCCCOc1cccc(Cc2cnc(N)nc2N)c1
CCOc1cc(Cc2cnc(N)nc2N)ccc1OCc1ccccc1
Nc1ncc(Cc2cccc(I)c2)c(N)n1
COc1ccc(Cc2cnc(N)nc2N)cc1
CS(=O)(=O)Oc1cccc(Cc2cnc(N)nc2N)c1
Nc1ncc(Cc2cc(CO)cc(CO)c2)c(N)n1
Nc1ncc(Cc2cccc(O)c2)c(N)n1
COCCOc1ccc(Cc2cnc(N)nc2N)cc1
Nc1ccc(Cc2cnc(N)nc2N)cc1
COCCOc1ccc(Cc2cnc(N)nc2N)cc1OC
Nc1ncc(Cc2ccc(cc2)[N+]([O-])=O)c(N)n1
Nc1ncc(Cc2ccc(Cl)cc2)c(N)n1
COc1cc(Cc2cnc(N)nc2N)ccc1OCc1ccccc1
CCOc1cc(Cc2cnc(N)nc2N)cc(OCC)c1-n1cccc1
CCCOc1cc(Cc2cnc(N)nc2N)cc(OCCC)c1
COc1cc(Cc2cnc(N)nc2N)ccc1O
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1
Nc1ncc(Cc2ccc(cc2)-c2ccccc2)c(N)n1
CCc1cc(Cc2cnc(N)nc2N)cc(CO)c1CO
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1C(C)=C
CCCCCCCCOc1c(OC)cc(Cc2cnc(N)nc2N)cc1OC
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1SC
COc1ccc(Cc2cnc(N)nc2N)cc1OCc1ccccc1
Cc1cc(C)cc(Cc2cnc(N)nc2N)c1
COCCOc1c(Cc2cnc(N)nc2N)ccc(OC)c1OC
COc1cc(Cc2cnc(N)nc2N)ccc1OS(C)(=O)=O
Nc1ncc(Cc2ccccc2)c(N)n1
COc1cccc(Cc2cnc(N)nc2N)c1
Nc1ncc(Cc2cccc(Br)c2)c(N)n1
CC(=O)Nc1ccc(Cc2cnc(N)nc2N)cc1
COc1ccc(cc1OC)Cc2cnc(nc2N)N
Nc1ncc(Cc2ccc(F)cc2)c(N)n1
COc1ccc(Cc2cnc(N)nc2N)cc1C(F)(F)F
CC(=O)Nc1ccc(Cc2cnc(N)nc2N)cc1[N+]([O-])=O
COc1ccc(Cc2cnc(N)nc2N)cc1O
CCCCCCCOc1ccc(Cc2cnc(N)nc2N)cc1
Nc1ncc(Cc2cccc(OCc3ccccc3)c2)c(N)n1
CCCOc1cc(Cc2cnc(N)nc2N)cc(OCC)c1
COCc1cccc(Cc2cnc(N)nc2N)c1
CCOc1cc(Cc2cnc(N)nc2N)cc(OCC)c1
COCCOc1c(OC)cc(Cc2cnc(N)nc2N)cc1OC
COCCOc1ccc(Cc2cnc(N)nc2N)cc1OCCOC
CCCCCCCOc1cccc(Cc2cnc(N)nc2N)c1
CCCCCCOc1ccc(Cc2cnc(N)nc2N)cc1
CCc1cc(Cc2cnc(N)nc2N)cc(NC(C)=O)c1CO
COc1cc(Cc2cnc(N)nc2N)cc(CC=C)c1OC
COc1c(CC=C)cc(Cc2cnc(N)nc2N)cc1CC=C
CCCc1cc(Cc2cnc(N)nc2N)cc(CCC)c1O
Nc1nc(N)c2N3C(CC(C3=O)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)CCc2n1
Nc1nc(N)c2N3CC(CC3CCc2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Cc1nc2nc(N)nc(N)c2cc1CNc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc(N)c2cc(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)c(nc2n1)-c1ccccc1
Cc1nc2nc(N)nc(N)c2c(-c2ccccc2)c1CNc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Cc1c(CNc2ccc(cc2)C(=O)NC(CCC(O)=O)C(O)=O)c(nc2nc(N)nc(N)c12)-c1ccccc1
Cc1nc2nc(N)nc(N)c2c(C)c1CNc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCP(O)(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCP(O)(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCCP(O)(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CP(O)(O)=O)C(O)=O)cnc2n1
c1cc(ccc1C(=O)N[C@@H](CCC(=O)O)C(=O)O)NCc2cnc3c(n2)c(nc(n3)N)N
c1ccc(c(c1)C(=O)NCCC[C@@H](C(=O)O)NC(=O)c2ccc(cc2)NCc3cnc4c(n3)c(nc(n4)N)N)C(=O)O
CCC(CC1CNc2nc(N)nc(N)c2N1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CCC(CC1=Nc2c(N)nc(N)nc2NC1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O |t:4|
CCCN1C=CC(C)=C2C(=O)NC(N)N=C12 |c:4,t:7,14|
CCN1C=C(C)C=C2C(=O)NC(N)N=C12 |t:3,6,13|
CCN1C=CC=C2C(=O)NC(N)N=C12 |c:3,t:5,12|
CN1C=CC(C)=C2C(=O)NC(N)N=C12 |c:2,t:5,12|
CN1C=CC=C2C(=O)NC(N)N=C12 |c:2,t:4,11|
CCCN1C=CC=C2C(=O)NC(N)N=C12 |c:4,t:6,13|
NC1NC(=O)C2=CC=CN(Cc3ccccc3)C2=N1 |c:7,19,t:5|
CC(C)CN1C=CC(C)=C2C(=O)NC(N)N=C12 |c:5,t:8,15|
CCCN1C(C)=CC=C2C(=O)NC(N)N=C12 |c:5,t:7,14|
CC(C)CCN1C=CC(C)=C2C(=O)NC(N)N=C12 |c:6,t:9,16|
CC(C)N1C=CC=C2C(=O)NC(N)N=C12 |c:4,t:6,13|
CCCN1C=C(C)C=C2C(=O)NC(N)N=C12 |t:4,7,14|
CN1C(C)=CC=C2C(=O)NC(N)N=C12 |c:3,t:5,12|
CC(C)CN1C=CC=C2C(=O)NC(N)N=C12 |c:5,t:7,14|
CN1C=C(C)C=C2C(=O)NC(N)N=C12 |t:2,5,12|
CC(C)N1C=C(C)C=C2C(=O)NC(N)N=C12 |t:4,7,14|
Nc1nc2ccc(CN(CC#C)c3ccc(cc3Cl)C(=O)NC(CCC(O)=O)C(O)=O)cc2c(=O)[nH]1
Nc1nc2ccc(CN(CC#C)c3c(Cl)cc(cc3Cl)C(=O)NC(CCC(O)=O)C(O)=O)cc2c(=O)[nH]1
Nc1nc2ccc(CN(CC#C)c3ccc(C(=O)NC(CCC(O)=O)C(O)=O)c(Cl)c3)cc2c(=O)[nH]1
Cc1cc(ccc1C(=O)NC(CCC(O)=O)C(O)=O)N(CC#C)Cc1ccc2nc(N)[nH]c(=O)c2c1
Nc1nc(N)c2cc(CN(C=O)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)ccc2n1
CN(Cc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O)c1ccc2nc(N)nc(N)c2c1
Nc1nc(N)c2cc(ccc2n1)N(Cc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O)C=O
Nc1nc(N)c2cc(NCc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)ccc2n1
CN(Cc1ccc2nc(N)nc(N)c2c1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc(N)c2cc(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)ccc2n1
CCOC(=O)C(CNC(=O)N(C)N=O)NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCNC(=O)c1ccc(Cl)cc1)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CNC(N)=O)C(O)=O
CNC(=O)NCC(NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCNC(N)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CNC(=O)NC(CCC(O)=O)C(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCNC(=O)c1ccc(Cl)cc1)C(O)=O
CCOC(=O)C(CNC(=O)N(CCCl)N=O)NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CNC(=O)c1ccc(Cl)cc1)C(O)=O
COc1cc(NCc2cnc3nc(N)nc(N)c3c2C)cc(OC)c1OC
COc1cc(cc(OC)c1OC)N(CC#C)Cc1cnc2nc(N)nc(N)c2c1C
COc1ccc(OC)c(NCc2cnc3nc(N)nc(N)c3c2C)c1
COc1cc(cc(OC)c1OC)N(Cc1cnc2nc(N)nc(N)c2c1C)C(C)C
CCN(Cc1cnc2nc(N)nc(N)c2c1C)c1cc(OC)c(OC)c(OC)c1
COc1cc(NCc2cnc3nc(N)nc(N)c3c2C)cc(OC)c1
COc1ccc(OC)c(c1)N(C)Cc1cnc2nc(N)nc(N)c2c1C
COc1cc(OC)cc(c1)N(C)Cc1cnc2nc(N)nc(N)c2c1C
Cc1c(cnc2c1c(nc(n2)N)N)C[N@@](C)c3cc(c(c(c3)OC)OC)OC
COc1ccc(NCc2cnc3nc(N)nc(N)c3c2C)cc1OC
COc1ccc(NCc2cnc3nc(N)nc(N)c3c2C)c2ccccc12
COc1ccc(N(C)Cc2cnc3nc(N)nc(N)c3c2C)c(OC)c1
COc1ccc(NCc2cnc3nc(N)nc(N)c3c2C)c(OC)c1
Cc1c(CNc2cccc3ccccc23)cnc2nc(N)nc(N)c12
CCOc1ccc(OCC)c(c1)N(C)Cc1cnc2nc(N)nc(N)c2c1C
CCOc1ccc(c(c1)NCc2cnc3c(c2C)c(nc(n3)N)N)OCC
COc1ccc(cc1OC)N(C)Cc1cnc2nc(N)nc(N)c2c1C
CN(Cc1ccc2nc(N)nc(N)c2n1)c1ccc(Cl)cc1
CN(Cc1ccc2nc(N)nc(N)c2n1)c1ccc(Cl)c(Cl)c1
CN(Cc1ccc2nc(N)nc(N)c2n1)c1cccc(Cl)c1
CN(Cc1cnc2nc(N)nc(N)c2c1C)c1ccc(Cl)c(Cl)c1
COc1ccc(OC)c(NCc2ccc3nc(N)nc(N)c3n2)c1
COc1cc(cc(OC)c1OC)N(C)Cc1ccc2nc(N)nc(N)c2c1Cl
COc1cc(NCc2ccc3nc(N)nc(N)c3n2)cc(OC)c1OC
COc1cc(cc(OC)c1OC)N(C)Cc1ccc2nc(N)nc(N)c2n1
COc1ccc(OC)c(NCc2ccc3nc(N)nc(N)c3c2Cl)c1
COc1cc(NCc2ccc3nc(N)nc(N)c3c2Cl)cc(OC)c1OC
Nc1nc(N)c2c(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)coc2n1
Nc1nc(N)c2c(CNCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)coc2n1
CC1=NC2N=C(N)NC(=O)C2C1Sc1ccncc1 |t:1,4|
CC1=NC2N=C(N)NC(=O)C2C1Sc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O |t:1,4|
CC1(N=C(N=C(N1c2ccc(cc2)Cl)N)N)C
Cc1cc(no1)NS(=O)(=O)c2ccc(cc2)N
CCN=NNc1cc(ccc1Cl)-c1c(N)nc(N)nc1CC |w:2.1|
Nc1nc(N)c2c(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cccc2n1
COc1ccc(OC)c(NCc2cccc3nc(N)nc(N)c23)c1
COc1ccc(OC)c(c1)C#Cc1cccc2nc(N)nc(N)c12
COc1cc(cc(OC)c1OC)N(C)Cc1cccc2nc(N)nc(N)c12
Nc1nc(N)c2c(CCc3ccccc3)cccc2n1
COc1cc(NCc2cccc3nc(N)nc(N)c23)cc(OC)c1OC
COc1cc(CCc2cccc3nc(N)nc(N)c23)cc(OC)c1OC
Nc1nc(N)c2c(\C=C\c3ccccc3)cccc2n1
Nc1nc(N)c2c(cccc2n1)C#Cc1ccccc1
CC1(C)N=C(N)N=C(N)N1c1cccc(c1)C(N)=O |t:3,6|
COc1cc(Cc2cnc(N)nc2N)cc(OCCCC(O)=O)c1Br
COc1cc(Cc2cnc(N)nc2N)cc(OCCCCCCC(O)=O)c1Br
COc1cc(Cc2cnc(N)nc2N)cc(OCCCCCC(O)=O)c1Br
COc1cc(Cc2cnc(N)nc2N)cc(OCCCCC(O)=O)c1Br
COc1cc(Cc2cnc(N)nc2N)cc(OCCC(=O)NCC(O)=O)c1Br
COc1cc(Cc2cnc(N)nc2N)cc(OCCC(=O)NC(CCC(O)=O)C(O)=O)c1Br
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(O)=O)C(O)=O |r|
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)NC(CCCCN)C(=O)NC(CCCCN)C(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)NC(CCCCN)C(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)NCc1ccccc1)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(N)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(N)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CNC(=O)CCC(NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)NCC(O)=O)C(O)=O
CN(C)C(=O)CCC(NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(=O)NCC(O)=O
CCCCCNC(=O)CCC(NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)N[C@@H](CC(O)=O)C(O)=O)C(O)=O
NC1=NCC(Cc2cccc(CO)c2)C(N)=N1 |c:16,t:1|
COc1cc(CC2CN=C(N)N=C2N)cc(OC)c1 |c:11,t:8|
COc1cc(CC2CN=C(N)N=C2N)ccc1O |c:11,t:8|
COc1ccc(CC2CN=C(N)N=C2N)cc1OCc1ccccc1 |c:12,t:9|
NC1=NC(=[NH2+])[N-]CC1Cc1ccc(cc1)[N+]([O-])=O |t:1|
CCCCCCCOc1cccc(CC2CN=C(N)N=C2N)c1 |c:19,t:16|
COCCCCCCCOc1cc(CC2CN=C(N)N=C2N)ccc1OC |c:19,t:16|
COc1cc(CC2CN=C(N)N=C2N)cc(OC)c1Br |c:11,t:8|
Cc1ccc(CC2CN=C(N)N=C2N)cc1 |c:11,t:8|
COc1ccc(CC2CN=C(N)N=C2N)cc1O |c:12,t:9|
CCCCCCCCOc1c(OC)cc(CC2CN=C(N)N=C2N)cc1OC |c:21,t:18|
COc1cc(CC2CN=C(N)N=C2N)ccc1OS(C)(=O)=O |c:11,t:8|
Cc1cc(CC2CN=C(N)N=C2N)cc(C)c1O |c:10,t:7|
COCCOc1ccc(CC2CN=C(N)N=C2N)cc1 |c:15,t:12|
COc1ccc(CC2CN=C(N)N=C2N)cc1C(F)(F)F |c:12,t:9|
NC1=NCC(Cc2ccc(Cl)cc2)C(N)=N1 |c:15,t:1|
Cc1cc(CC2CN=C(N)N=C2N)cc(Cl)c1N |c:10,t:7|
NC(=O)COc1cccc(CC2CN=C(N)N=C2N)c1 |c:16,t:13|
NC1=NCC(Cc2cccc(Cl)c2)C(N)=N1 |c:15,t:1|
NC1=NCC(Cc2cc(CO)cc(CO)c2)C(N)=N1 |c:18,t:1|
COCCCCCCCOc1c(OC)cc(CC2CN=C(N)N=C2N)cc1OC |c:22,t:19|
NC1=NCC(Cc2ccc(N)cc2)C(N)=N1 |c:15,t:1|
COc1cc(CC2CN=C(N)N=C2N)ccc1Cc1ccccc1 |c:11,t:8|
CCCCCCOc1ccc(CC2CN=C(N)N=C2N)cc1 |c:17,t:14|
COCCOc1cccc(CC2CN=C(N)N=C2N)c1 |c:16,t:13|
NC1=NCC(Cc2cccc(F)c2)C(N)=N1 |c:15,t:1|
COc1cc(CC2CN=C(N)N=C2N)cc(OC)c1OCc1ccccc1 |c:11,t:8|
NC1=NCC(Cc2ccccc2)C(N)=N1 |c:14,t:1|
CCCCOc1cccc(CC2CN=C(N)N=C2N)c1 |c:16,t:13|
COc1ccc(CC2CN=C(N)N=C2N)cc1OS(C)(=O)=O |c:12,t:9|
CCCCOCc1cccc(CC2CN=C(N)N=C2N)c1 |c:17,t:14|
CCCCCCCCOc1cccc(CC2CN=C(N)N=C2N)c1 |c:20,t:17|
NC1=NCC(Cc2cc(Cl)c(N)c(Cl)c2)C(N)=N1 |c:17,t:1|
COc1cc(CC2CN=C(N)N=C2N)cc(OC)c1OC |c:11,t:8|
Cc1cc(C)cc(CC2CN=C(N)N=C2N)c1 |c:13,t:10|
NC1=NCC(Cc2ccc3OCCOc3c2)C(N)=N1 |c:19,t:1|
CCCOc1cc(CC2CN=C(N)N=C2N)cc(OCCC)c1 |c:13,t:10|
NC1=NCC(Cc2ccc(F)cc2)C(N)=N1 |c:15,t:1|
CC(=O)Nc1ccc(CC2CN=C(N)N=C2N)cc1 |c:14,t:11|
COc1cccc(CC2CN=C(N)N=C2N)c1 |c:13,t:10|
COc1c(I)cc(CC2CN=C(N)N=C2N)cc1I |c:13,t:10|
NC1=NCC(Cc2ccc(cc2)-c2ccccc2)C(N)=N1 |c:21,t:1|
Cc1cccc(CC2CN=C(N)N=C2N)c1 |c:12,t:9|
NC1=NCC(Cc2cccc(OCc3ccccc3)c2)C(N)=N1 |c:23,t:1|
CS(=O)(=O)Oc1ccc(CC2CN=C(N)N=C2N)cc1 |c:15,t:12|
NC1=NCC(Cc2ccc(OCc3ccccc3)cc2)C(N)=N1 |c:23,t:1|
NC1=NCC(Cc2cccc(O)c2)C(N)=N1 |c:15,t:1|
COc1ccc(CC2CN=C(N)N=C2N)cc1 |c:12,t:9|
NC1=NCC(Cc2ccc(O)cc2)C(N)=N1 |c:15,t:1|
COc1c(C)cc(CC2CN=C(N)N=C2N)cc1C |c:13,t:10|
NC1=NCC(Cc2cccc(c2)C(F)(F)F)C(N)=N1 |c:18,t:1|
COc1ccc(CC2CN=C(N)N=C2N)cc1OC |c:12,t:9|
CCCCCCOc1cccc(CC2CN=C(N)N=C2N)c1 |c:18,t:15|
CCCCOc1ccc(CC2CN=C(N)N=C2N)cc1 |c:15,t:12|
CCCCCCCOc1ccc(CC2CN=C(N)N=C2N)cc1 |c:18,t:15|
COc1cc(CC2CN=C(N)N=C2N)cc(OC)c1N(C)C |c:11,t:8|
COCCC(=O)c1ccc(CC2CN=C(N)N=C2N)cc1C(=O)CCOC |c:16,t:13|
NC1=NCC(Cc2cccc(Br)c2)C(N)=N1 |c:15,t:1|
NC1=NCC(Cc2ccc(OC(F)(F)F)cc2)C(N)=N1 |c:19,t:1|
NC1=NCC(Cc2cccc(I)c2)C(N)=N1 |c:15,t:1|
CCc1cc(CC2CN=C(N)N=C2N)cc(CC)c1CC |c:11,t:8|
NC1=NCC(Cc2cc(Br)c(N)c(Br)c2)C(N)=N1 |c:17,t:1|
CS(=O)(=O)Oc1cccc(CC2CN=C(N)N=C2N)c1 |c:16,t:13|
COCCc1c(OC)cc(CC2CN=C(N)N=C2N)cc1OC |c:16,t:13|
COCCOc1ccc(CC2CN=C(N)N=C2N)cc1OC |c:15,t:12|
CCCCCCOc1c(OC)cc(CC2CN=C(N)N=C2N)cc1OC |c:19,t:16|
NC1=NCC(Cc2cc(O)cc(O)c2)C(N)=N1 |c:16,t:1|
NC1=NCC(Cc2cc(I)c(O)c(I)c2)C(N)=N1 |c:17,t:1|
CC(=O)Nc1ccc(CC2C[N-]C(=[NH2+])N=C2N)cc1[N+]([O-])=O |c:14|
NC1=NCC(Cc2ccc(Br)cc2)C(N)=N1 |c:15,t:1|
COc1cc(CC2CN=C(N)N=C2N)cc(OC)c1C |c:11,t:8|
COCc1cccc(CC2CN=C(N)N=C2N)c1 |c:14,t:11|
CN(C)c1ccc(CC2CN=C(N)N=C2N)cc1 |c:13,t:10|
Nc1nc(N)c2cc(Sc3cccc(c3)C(F)(F)F)sc2n1
Nc1nc(N)c2c3ccn(Cc4ccc(Cl)cc4Cl)c3cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)NC(CCC(=O)NC(CCC(=O)NC(CCC(O)=O)C(O)=O)C(O)=O)C(O)=O)C(O)=O
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(NCN(C)C)c1
Cc1c(CNc2ccc(Cl)c(c2)C(=O)NC(CC(O)=O)C(O)=O)ccc2nc(N)nc(N)c12
Nc1ccc(cc1)S(=O)(=O)c1ccc(N)cc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)[N+]#N
CN(Cc1cnc2cc(N)cc(N)c2n1)c1ccc(C(=O)NC(CCC(O)=O)C(O)=O)c2ccccc12
COc1ccc(OC)c(CCc2sc3nc(N)nc(N)c3c2C)c1
Nc1cc(N)c2nc(CSc3ccccc3)cnc2c1
COc1cc(Cn2ccc3c2c(=O)[nH]c2nc(N)nc(N)c32)cc(OC)c1OC
Cc1cccc(SCc2cnc3nc(N)nc(N)c3c2C)c1
COc1cc(NCc2cnc3nc(N)nc(N)c3n2)cc(OC)c1OC
Nc1nc(N)c2cc(CNc3ccc(Cl)cc3)ccc2n1
Nc1nc(N)c2cc(CNc3cccc4ccccc34)cnc2n1
COc1cccc(SCc2cnc3nc(N)nc(N)c3n2)c1
COc1ccc(OC)c(NCc2ccc3nc(N)nc(N)c3c2)c1
Cc1c(CCc2cccc3ccccc23)cnc2nc(N)nc(N)c12
Nc1nc(N)c2nc(CSc3ccccc3)cnc2n1
COc1ccc(SCc2cnc3nc(N)nc(N)c3n2)cc1
Nc1nc(N)c2nc(CSc3cccc4ccccc34)cnc2n1
Cc1cccc(SCc2cnc3nc(N)nc(N)c3n2)c1
COc1cc(NCc2cnc3nc(N)nc(N)c3n2)cc(OC)c1
Cc1ccc(C)c(NCc2cnc3nc(N)nc(N)c3c2C)c1
COc1ccc(NCc2cnc3nc(N)nc(N)c3c2C)c(C)c1
Cc1c(CSc2cccc3ccccc23)cnc2nc(N)nc(N)c12
COc1ccc(C)cc1NCc1cnc2nc(N)nc(N)c2c1C
Nc1nc(N)c2cc(CNc3cccc4ccccc34)ccc2n1
Nc1nc(N)c2cc(CNc3ccc(Cl)cc3)cnc2n1
COc1ccc(C)c(NCc2cnc3nc(N)nc(N)c3n2)c1
CN(Cc1cnc2nc(N)nc(N)c2c1C)c1cccc2CCCCc12
COc1ccc(SCc2cnc3nc(N)nc(N)c3c2C)cc1
Nc1nc(N)c2nc(CCc3cccc4ccccc34)cnc2n1
COc1cc(NCc2cnc3nc(N)nc(N)c3c2C)cc(c1)C(F)(F)F
COc1ccc(OC)c(c1)N(C)Cc1cnc2nc(N)nc(N)c2n1
COc1ccc(SCc2cnc3nc(N)nc(N)c3c2C)cc1OC
Nc1nc(N)c2nc(CNc3cccc4ccccc34)cnc2n1
COc1ccc(OC)c(CCc2cnc3nc(N)nc(N)c3c2C)c1
COc1ccc(cc1N(C)Cc1cnc2nc(N)nc(N)c2c1C)C(F)(F)F
Cc1c(CNc2cccc3CCCCc23)cnc2nc(N)nc(N)c12
COc1ccc(OC)c(CCc2cnc3nc(N)nc(N)c3n2)c1
Cc1c(CSc2cccc(Cl)c2)cnc2nc(N)nc(N)c12
Nc1nc(N)c2nc(CSc3cccc(Cl)c3)cnc2n1
Cc1ccc(SCc2cnc3nc(N)nc(N)c3c2C)cc1
Cc1c(CSc2ccccc2)cnc2nc(N)nc(N)c12
COc1cccc(SCc2cnc3nc(N)nc(N)c3c2C)c1
Cc1cc(Cl)ccc1NCc1ccc2nc(N)nc(N)c2c1
Cc1c(CNc2ccc(Cl)cc2)cnc2nc(N)nc(N)c12
COc1cc(NCc2cnc3nc(N)nc(N)c3c2)cc(OC)c1OC
Nc1nc(N)c2nc(CNc3ccc(Cl)cc3)cnc2n1
Cc1c(CSc2ccc(Cl)cc2)cnc2nc(N)nc(N)c12
COc1ccc(cc1NCc1cnc2nc(N)nc(N)c2n1)C(F)(F)F
COc1cc(NCc2cnc3nc(N)nc(N)c3n2)cc(c1)C(F)(F)F
Cc1ccc(SCc2cnc3nc(N)nc(N)c3n2)cc1
COc1cccc(C)c1NCc1cnc2nc(N)nc(N)c2c1C
COc1ccc(OC)c(NCc2cnc3nc(N)nc(N)c3n2)c1
COc1ccc(C)c(NCc2cnc3nc(N)nc(N)c3c2C)c1
COc1cccc(C)c1NCc1cnc2nc(N)nc(N)c2n1
Nc1nc(N)c2nc(CSc3ccc(Cl)cc3)cnc2n1
COc1ccc(cc1NCc1cnc2nc(N)nc(N)c2c1C)C(F)(F)F
COc1ccc(SCc2cnc3nc(N)nc(N)c3n2)cc1OC
N[C@H](CCC(O)=O)C(=O)NC(=O)c1ccc(CNc2cnc3nc(N)nc(N)c3c2)cc1
CN(Cc1ccc(cc1)C(=O)NC(=O)[C@H](N)CCC(O)=O)c1cnc2nc(N)nc(N)c2c1
COc1cc(CNc2cnc3nc(N)nc(N)c3c2)cc(OC)c1
COc1ccc(OC)c(CNc2cnc3nc(N)nc(N)c3c2)c1
COc1cc(CNc2cnc3nc(N)nc(N)c3c2)cc(OC)c1OC
C[N@](Cc1cc(ccc1OC)OC)c2cc3c(nc(nc3nc2)N)N
Nc1nc(N)c2c(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)coc2n1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N1CCc2ccccc2C1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccccc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N1CCOCC1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(C)C
CCCN(C)\N=N\c1cc(ccc1Cl)-c1c(N)nc(N)nc1CC
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)N=[N+]=[N-]
CCN(CCO)\N=N\c1cc(ccc1Cl)-c1c(N)nc(N)nc1CC
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(C)CCO
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(NN=NC)c1 |w:18.19|
CCCN(CCO)\N=N\c1cc(ccc1Cl)-c1c(N)nc(N)nc1CC
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCO)CCO
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=C\N(C)C
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(C)CC1OCCO1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC)CCOC
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N1CCCC1
CCN(C)\N=N\c1cc(ccc1Cl)-c1c(N)nc(N)nc1CC
CCN(CC)\N=N\c1cc(ccc1Cl)-c1c(N)nc(N)nc1CC
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N1CCCCC1
CCN(CC)CCN(C)\N=N\c1cc(ccc1Cl)-c1c(N)nc(N)nc1CC
CCc1nc(N)nc(N)c1-c1ccc(N(C)Cc2ccccc2)c(c1)[N+]([O-])=O
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(C)Cc1ccccc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)[N+]([O-])=O
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N1CCC(O)CC1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCO)Cc1ccccc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(C(C)(C)C)C(C)(C)C
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCO)C(C)(C)C
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N1CCN(C)CC1
COc1cc(cc(OC)c1OC)N1CCc2c(C1)cnc1nc(N)nc(N)c21
COc1cc(cc(OC)c1OC)-n1ccc2c(c1)c(=O)nc1nc(N)nc(N)c21
COc1c(Cl)c(c(Cl)c(OC)c1OC)-n1ccc2c(c1)c(=O)nc1nc(N)nc(N)c21
COc1cc(cc(OC)c1OC)N1CCC2=c3c(N)nc(N)nc3=NC(=O)C2=C1 |c:16,25,30|
COc1cc(cc(OC)c1OC)N1CCc2c(C1)c(=O)[nH]c1nc(N)nc(N)c21
COc1cc(cc(OC)c1OC)[NH+]1Cc2cnc3nc(N)nc(N)c3c2C=C1 |c:29|
COc1cc(cc(OC)c1OC)N1CCC2C(CNc3nc(N)nc(N)c23)C1
CCc1nc(N)nc(N)c1-c1ccc(N(C)Cc2ccc(cc2)C(O)=O)c(c1)[N+]([O-])=O
CCc1nc(N)nc(N)c1-c1ccc(N(C)Cc2ccc(cc2)C(=O)NC)c(c1)[N+]([O-])=O
COc1ccc(OC)c(NCc2c(Br)sc3nc(N)nc(N)c23)c1
COc1cc(cc(OC)c1OC)N(C)Cc1c(Br)sc2nc(N)nc(N)c12
COc1ccc(OC)c(c1)N(C)Cc1c(Br)sc2nc(N)nc(N)c12
COc1cc(NCc2c(Br)sc3nc(N)nc(N)c23)cc(OC)c1OC
Nc1nc(N)c2c(CNc3cc(Cl)c(c(Cl)c3)-n3cccc3)c(Br)sc2n1
COc1ccc(CCC2CNc3nc(N)nc(N)c3C2)cc1OC
CCN(Cc1cnc2nc(N)nc(N)c2c1)c1cc(OC)c(OC)c(OC)c1
COc1ccc(\C=C\c2cnc3nc(N)nc(N)c3c2)cc1
COc1cc(\C=C\c2cnc3nc(N)nc(N)c3c2)cc(OC)c1OC
COc1cc(cc(OC)c1OC)N(C)Cc1cnc2nc(N)nc(N)c2c1
COc1ccc(CCc2cnc3nc(N)nc(N)c3c2)cc1OC
COc1cc(CCC2CNc3nc(N)nc(N)c3C2)cc(OC)c1OC
COc1cc(cc(OC)c1OC)N(Cc1cnc2nc(N)nc(N)c2c1)C=O
COc1cc(CCc2cnc3nc(N)nc(N)c3c2)cc(OC)c1OC
COc1ccc(\C=C\c2cnc3nc(N)nc(N)c3c2)cc1OC
COc1ccc(CCc2cnc3nc(N)nc(N)c3c2)cc1
COc1cc(CN(C)CC2CCc3nc(N)nc(N)c3C2)cc(OC)c1OC
Nc1nc(N)c2CC(CNc3cccc(Br)c3)CCc2n1
COc1cc(NCC2CCc3nc(N)nc(N)c3C2)cc(OC)c1OC
CN(CC1CCc2nc(N)nc(N)c2C1)c1ccc(Cl)cc1
Nc1nc(N)c2CC(CNc3ccc(Cl)cc3)CCc2n1
Nc1nc(N)c2CC(CNc3c(Cl)cccc3Cl)CCc2n1
CCOc1ccc(OCC)c(NCC2CCc3nc(N)nc(N)c3C2)c1
CN(CC1CCc2nc(N)nc(N)c2C1)c1ccc(Cl)c(Cl)c1
CN(CC1CCc2nc(N)nc(N)c2C1)c1cccc2ccccc12
CCOc1ccc(OCC)c(c1)N(C)CC1CCc2nc(N)nc(N)c2C1
Nc1nc(N)c2CC(CNc3cccc4ccccc34)CCc2n1
COc1ccc(OC)c(NCC2CCc3nc(N)nc(N)c3C2)c1
COc1cc(CNCC2CCc3nc(N)nc(N)c3C2)cc(OC)c1OC
Nc1nc(N)c2CC(CNc3cc(Cl)ccc3Cl)CCc2n1
CCN(CC1CCc2nc(N)nc(N)c2C1)c1cc(OC)ccc1OC
COc1cc(cc(OC)c1OC)N(C)CC1CCc2nc(N)nc(N)c2C1
COc1cc(cc(OC)c1OC)N(CC#C)CC1CCc2nc(N)nc(N)c2C1
Nc1nc(N)c2CC(CNc3ccc(Cl)c(Cl)c3)CCc2n1
Nc1nc(N)c2CC(CN3CCc4ccccc34)CCc2n1
COc1ccc(OC)c(c1)N(C)CC1CCc2nc(N)nc(N)c2C1
Nc1nc(N)c2cc(NCc3ccccc3)ccc2n1
COc1ccc(CNc2ccc3nc(N)nc(N)c3c2)c(OC)c1OC
COc1cc(CNc2ccc3nc(N)nc(N)c3c2)cc(OC)c1OC
CN(Cc1cc(ccc1OC)OC)c2ccc3c(c2)c(nc(n3)N)N
COc1cc(CN(C)c2ccc3nc(N)nc(N)c3c2)cc(OC)c1
COc1ccc(CN(C)c2ccc3nc(N)nc(N)c3c2)c(OC)c1
COc1cc(OC)c(CNc2ccc3nc(N)nc(N)c3c2)c(OC)c1
Nc1nc(N)c2cc(NCc3cccc4CCCCc34)ccc2n1
COc1cc(CNc2ccc3nc(N)nc(N)c3c2)cc(OC)c1
COc1ccc(OC)c(CNc2ccc3nc(N)nc(N)c3c2)c1
COc1ccc(CNc2ccc3nc(N)nc(N)c3c2)c(OC)c1
COc1ccc(CN(C)c2ccc3nc(N)nc(N)c3c2)c(OC)c1OC
CN(Cc1cccc2CCCCc12)c1ccc2nc(N)nc(N)c2c1
COc1cc(OC)c(OC)cc1CNc1ccc2nc(N)nc(N)c2c1
Nc1nc(N)c2c(CNc3ccccc3)c[nH]c2n1
Nc1nc(N)c2c(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)c[nH]c2n1
COc1ccc(NCc2c[nH]c3nc(N)nc(N)c23)cc1
COc1ccc(OC)c(NCc2c[nH]c3nc(N)nc(N)c23)c1
COc1ccc(NCc2c[nH]c3nc(N)nc(N)c23)cc1OC
Nc1nc(N)c2c(CNc3cccc4ccccc34)c[nH]c2n1
COc1cc(NCc2c[nH]c3nc(N)nc(N)c23)cc(OC)c1OC
Nc1nc(N)c2c(CNc3ccc(Cl)c(Cl)c3)c[nH]c2n1
CCOc1ccc(OCC)c(NCc2c[nH]c3nc(N)nc(N)c23)c1
CN(c1ccc2ccccc2c1)c1ccc2nc(N)nc(N)c2n1
COc1cc(CCC2CCc3nc(N)nc(N)c23)cc(OC)c1OC
COc1cc(CCCC2CCc3nc(N)nc(N)c23)cc(OC)c1OC
COc1cc(CC2CCc3nc(N)nc(N)c23)cc(OC)c1OC
CN(Cc1coc2nc(N)nc(N)c12)c1ccc2ccccc2c1
Nc1nc(N)c2c(CNc3ccccc3Oc3ccccc3)coc2n1
Nc1nc(N)c2c(CNc3ccccc3-c3ccccc3)coc2n1
Nc1nc(N)c2c(CSc3cccc4ccccc34)coc2n1
CN(Cc1coc2nc(N)nc(N)c12)c1ccc(Cl)c(Cl)c1
Nc1nc(N)c2c(CSc3ccc4ccccc4c3)coc2n1
COc1cccc(NCc2coc3nc(N)nc(N)c23)c1
Nc1nc(N)c2c(CSc3ccccc3)coc2n1
CN(Cc1coc2nc(N)nc(N)c12)c1cc(Cl)c(Cl)c(Cl)c1
COc1ccc(OC)c(c1)N(C)Cc1coc2nc(N)nc(N)c12
Nc1nc(N)c2c(CNc3cc(Cl)ccc3Cl)coc2n1
Nc1nc(N)c2c(CNc3cccc4ccccc34)coc2n1
Nc1nc(N)c2c(CNc3ccc4ccccc4c3)coc2n1
Nc1nc(N)c2c(CNc3ccc(Oc4ccccc4)cc3)coc2n1
Nc1nc(N)c2c(COc3ccc4ccccc4c3)coc2n1
Nc1nc(N)c2c3CCN(Cc4ccccc4)Cc3oc2n1
Nc1nc(N)c2c3CCN(Cc4ccc(cc4)C(=O)N[C@@H](CCC(O)=O)C(O)=O)Cc3oc2n1
Nc1nc(N)c2c3CCN(Cc4c(Cl)cccc4Cl)Cc3oc2n1
COc1cc(CN2CCc3c(C2)oc2nc(N)nc(N)c32)cc(OC)c1
Nc1nc(N)c2c3CCN(Cc4ccc(Cl)c(Cl)c4)Cc3oc2n1
COc1cc(CN2CCc3c(C2)oc2nc(N)nc(N)c32)cc(OC)c1OC
Nc1nc(N)c2c3CCN(Cc4ccc(Cl)cc4Cl)Cc3oc2n1
Cc1c(Cc2ccccc2)sc2nc(N)nc(N)c12
Cc1sc2nc(N)nc(N)c2c1-c1ccc(Cl)cc1
Nc1nc(N)c2c3CCCCCCCCCCc3sc2n1
Nc1nc(N)c2nc(CC(CC#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
CCCCCC(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CCCC(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
COc1ccc(OC)c(c1)N(C)Cc1cccc2nc(N)nc(N)c12
COc1ccc(OC)c(CCc2cccc3nc(N)nc(N)c23)c1
Nc1nc(N)c2cc(CNc3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccccc3C(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2c(Cl)c(CNc3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccccc3C(O)=O)C(O)=O)ccc2n1
Cc1c(CNc2ccc(cc2)C(=O)NC(CCCNC(=O)c2ccccc2C(O)=O)C(O)=O)cnc2nc(N)nc(N)c12
Cc1c(CNc2ccc(cc2)C(=O)NC(CCCNC(=O)c2ccccc2C(O)=O)C(O)=O)ccc2nc(N)nc(N)c12
Nc1nc(N)c2cc(CNc3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccccc3C(O)=O)C(O)=O)ccc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccccc3C(O)=O)C(O)=O)ccc2n1
COc1cc(Cc2sc3nc(N)nc(N)c3c2C)cc(OC)c1OC
Nc1nc(N)c2c3CCCCCc3sc2n1
Cc1c(sc2nc(N)nc(N)c12)-c1ccc(Cl)c(Cl)c1
COc1ccc(OC)c(Cc2sc3nc(N)nc(N)c3c2C)c1
COc1ccc(OC)c(c1)-c1sc2nc(N)nc(N)c2c1C
COc1ccc(c(c1)CCc2csc3c2c(nc(n3)N)N)OC
Cc1sc2nc(N)nc(N)c2c1Cc1ccccc1
Cc1c(sc2nc(N)nc(N)c12)-c1ccccc1
COc1cc(cc(OC)c1OC)-c1sc2nc(N)nc(N)c2c1C
CN(Cc1cnc2nc(N)nc(N)c2c1C)c1cc(Cl)c(Cl)c(Cl)c1
Cc1c(CNc2ccc(Cl)c(Cl)c2)cnc2nc(N)nc(N)c12
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(C(=O)NC(CCC(O)=O)C(O)=O)c2ccccc12
Nc1nc(N)c2cc(CNc3ccc(C(=O)NC(CCC(O)=O)C(O)=O)c4ccccc34)cnc2n1
Nc1nc(N)c2cc(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
COc1cc(NCc2coc3nc(N)nc(N)c23)cc(OC)c1OC
C[N@](Cc1coc2c1c(nc(n2)N)N)c3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O
Nc1nc(N)c2c(CNc3ccc(Cl)c(Cl)c3)coc2n1
Nc1nc(N)c2c(CNc3cc(Cl)c(Cl)c(Cl)c3)coc2n1
Nc1nc(N)c2c(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)coc2n1
COc1ccc(OC)c(NCc2coc3nc(N)nc(N)c23)c1
Nc1nc(N)c2c(CCCCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)coc2n1
Nc1nc(N)c2c(CCCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)coc2n1 |r|
Nc1nc2[nH]c(CCCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cc2c(=O)[nH]1 |r|
c1cc(ccc1CCCCc2cc3c([nH]2)N=C(NC3=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O
Nc1nc(N)c2c3CCN(Cc4ccccc4)Cc3sc2n1
Nc1nc(N)c2c3CCCCc3sc2n1
COc1cc(CCc2sc3nc(N)nc(N)c3c2C)cc(OC)c1OC
Nc1nc(N)c2c3CCCCCCc3sc2n1
COc1ccc(OC)c(CCCc2csc3nc(N)nc(N)c23)c1
Cc1c(CNc2cc(Cl)c(Cl)c(Cl)c2)cnc2nc(N)nc(N)c12
Cc1c(CN(C=O)c2ccc(Cl)c(Cl)c2)cnc2nc(N)nc(N)c12
COc1cc(NCC2CNc3nc(N)nc(N)c3C2C)cc(OC)c1OC
COc1cc(cc(OC)c1OC)N(Cc1cnc2nc(N)nc(N)c2c1C)C=O
COc1cc(cc(OC)c1OC)N(CC1CNc2nc(N)nc(N)c2C1C)C=O
COc1cc(cc(OC)c1OC)N(CC1C=Nc2nc(N)nc(N)c2C1C)C=O |c:16|
Cc1c(CN(C=O)c2cc(Cl)c(Cl)c(Cl)c2)cnc2nc(N)nc(N)c12
Cc1c(CNc2ccc(C(=O)NC(CCC(O)=O)C(O)=O)c3ccccc23)cnc2nc(N)nc(N)c12
CN(Cc1cnc2nc(N)nc(N)c2c1)c1ccc(C(=O)NC(CCC(O)=O)C(O)=O)c2ccccc12
Nc1nc(N)c2nc(CNc3ccc(C(=O)NC(CCC(O)=O)C(O)=O)c4ccccc34)cnc2n1
Nc1nc(N)c2cc(CNc3ccc(C(=O)NC(CCC(O)=O)C(O)=O)c4CCCCc34)cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2c1C)c1ccc(C(=O)NC(CCC(O)=O)C(O)=O)c2ccccc12
Nc1nc(N)c2cc(CNc3ccc(C(=O)NC(CCC(O)=O)C(O)=O)c4ccccc34)ccc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CC(F)(F)C(O)=O)C(O)=O
CN(Cc1ccc2nc(N)nc(N)c2n1)c1ccccc1Cl
CC(=O)c1ccc(NCc2ccc3nc(N)nc(N)c3n2)cc1
Nc1nc(N)c2nc(CNc3ccc4ccccc4c3)ccc2n1
Nc1nc(N)c2nc(CSc3ccccc3)ccc2n1
Nc1nc(N)c2nc(CNc3cccc4ccccc34)ccc2n1
CN(Cc1ccc2nc(N)nc(N)c2n1)c1ccc2ccccc2c1
COc1ccc(NCc2ccc3nc(N)nc(N)c3n2)cc1
CN(Cc1ccc2nc(N)nc(N)c2n1)c1c(Cl)cccc1Cl
CN(Cc1ccc2nc(N)nc(N)c2n1)c1ccc(cc1)C(C)=O
CN(Cc1ccc2nc(N)nc(N)c2n1)c1cc(Cl)c(Cl)c(Cl)c1
Nc1nc(N)c2nc(CN(CC#C)c3ccc(cc3)C(=O)C(F)(F)F)ccc2n1
CN(Cc1ccc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)C(F)(F)F
CN(Cc1ccc2nc(N)nc(N)c2n1)c1c(Cl)cc(Cl)cc1Cl
Nc1nc(N)c2nc(CNc3ccccc3)ccc2n1
Nc1nc(N)c2nc(CNc3cc(Cl)c(Cl)c(Cl)c3)ccc2n1
COc1ccc(NCc2ccc3nc(N)nc(N)c3n2)cc1OC
Nc1nc(N)c2nc(CSc3ccc4ccccc4c3)ccc2n1
CC(=O)c1ccc(cc1)N(CC#C)Cc1ccc2nc(N)nc(N)c2n1
COc1ccc(cc1)N(C)Cc1ccc2nc(N)nc(N)c2n1
COc1ccc(N(C)Cc2ccc3nc(N)nc(N)c3n2)c(OC)c1
CN(Cc1ccc2nc(N)nc(N)c2n1)c1cccc2ccccc12
COc1cccc(c1)N(C)Cc1ccc2nc(N)nc(N)c2n1
COc1ccccc1NCc1ccc2nc(N)nc(N)c2n1
COc1ccc(NCc2ccc3nc(N)nc(N)c3n2)c(OC)c1
Nc1nc(N)c2nc(CNc3c(Cl)cccc3Cl)ccc2n1
COc1cccc(NCc2ccc3nc(N)nc(N)c3n2)c1
CN(Cc1ccc2nc(N)nc(N)c2n1)c1cc(Cl)ccc1Cl
Nc1nc(N)c2nc(CNc3cc(Cl)ccc3Cl)ccc2n1
COc1ccc(cc1OC)N(C)Cc1ccc2nc(N)nc(N)c2n1
Nc1nc(N)c2nc(CNc3ccccc3Cl)ccc2n1
Nc1nc(N)c2nc(CNc3ccc(Cl)c(Cl)c3)ccc2n1
Nc1nc(N)c2nc(CSc3cccc4ccccc34)ccc2n1
CN(Cc1ccc2nc(N)nc(N)c2n1)c1ccccc1
Nc1nc(N)c2nc(CNc3ccc(Cl)cc3Cl)ccc2n1
CN(Cc1ccc2nc(N)nc(N)c2n1)c1ccc(Cl)cc1Cl
COc1ccccc1N(C)Cc1ccc2nc(N)nc(N)c2n1
COc1ccc(OC)c(c1)N(C)Cc1ccc2nc(N)nc(N)c2n1
Nc1nc(N)c2nc(CNc3cccc(Cl)c3)ccc2n1
Nc1nc(N)c2nc(CNc3c(Cl)cc(Cl)cc3Cl)ccc2n1
CCC(CC)n1c(CC)cc2c1ccc1nc(N)nc(N)c21
CCCCc1cc2c(ccc3nc(N)nc(N)c23)n1C(C)(C)C
CC(C)c1cc2c(ccc3nc(N)nc(N)c23)[nH]1
CCc1cc2c(ccc3nc(N)nc(N)c23)n1CC
Nc1nc(N)c2c3cc[nH]c3ccc2n1
CCC(CC)n1c(C)cc2c1ccc1nc(N)nc(N)c21
CC(C)n1c(C)cc2c1ccc1nc(N)nc(N)c21
CCc1cc2c(ccc3nc(N)nc(N)c23)n1C(C)(C)C
CC(C)n1c(cc2c1ccc1nc(N)nc(N)c21)C(C)(C)C
Cc1cc2c(ccc3nc(N)nc(N)c23)n1C
Cn1ccc2c1ccc1nc(N)nc(N)c21
CC(C)(C)c1cc2c(ccc3nc(N)nc(N)c23)[nH]1
CCC(C)n1c(CC)cc2c1ccc1nc(N)nc(N)c21
CCn1c(cc2c1ccc1nc(N)nc(N)c21)C(C)C
CCC(C)(C)n1c(C)cc2c1ccc1nc(N)nc(N)c21
COc1cc(Cn2ccc3c2ccc2nc(N)nc(N)c32)cc(OC)c1OC
CCc1cc2c(ccc3nc(N)nc(N)c23)n1C
CCCc1cc2c(ccc3nc(N)nc(N)c23)n1CC
CCC(CC)n1c(cc2c1ccc1nc(N)nc(N)c21)C(C)C
CCCc1cc2c(ccc3nc(N)nc(N)c23)n1C(CC)CC
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CC(F)(F)CN)C(O)=O
COc1cc(OC)c(OC)cc1CNc1cnc2nc(N)nc(N)c2c1
Nc1nc(N)c2cc(NCc3ccccc3)cnc2n1
CN(CCc1ccccc1)c1cnc2nc(N)nc(N)c2c1
CN(Cc1cc(c(c(c1)OC)OC)OC)c2cc3c(nc(nc3nc2)N)N
COc1ccc2c(CNc3cnc4nc(N)nc(N)c4c3)cccc2c1
COc1cc(OC)c(CNc2cnc3nc(N)nc(N)c3c2)c(OC)c1
COc1ccc(CNc2cnc3nc(N)nc(N)c3c2)cc1OC
COc1ccc(CNc2cnc3nc(N)nc(N)c3c2)c2ccccc12
CN(Cc1cc(cc(c1)OC)OC)c2cc3c(nc(nc3nc2)N)N
Nc1nc(N)c2cc(NCCc3ccccc3)cnc2n1
COc1ccc(CNc2cnc3nc(N)nc(N)c3c2)c(OC)c1OC
COc1cc(cc(OC)c1OC)C(C)Nc1cnc2nc(N)nc(N)c2c1
COc1ccc(CN(C)c2cnc3nc(N)nc(N)c3c2)c(OC)c1OC
CN(Cc1ccccc1)c1cnc2nc(N)nc(N)c2c1
Nc1nc(N)c2cc(NCc3cccc4ccccc34)cnc2n1
Nc1nc(N)c2cc(NCc3ccc(Oc4ccccc4)cc3)cnc2n1
Cc1c(c(nc(n1)N)N)C#C[C@H](C)c2cc(c(cc2OC)c3ccccc3)OC
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(cc1OC)-c1ccccc1
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(cc1OC)-c1ccncc1
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(cc1OC)-c1ccc(O)cc1
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(cc1OC)-c1ccc(C)cc1
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(cc1OC)-c1ccc(cc1)C#N
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(cc1OC)-c1ccc(OC(N)=O)cc1
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(cc1OC)-c1ccc(cc1)C(=O)OC
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(cc1OC)-c1ccc(cc1)N(C)C
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(cc1OC)-c1ccc(F)cc1
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(cc1)-c1ccccc1
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(nc1)-c1ccccc1
CCc1nc(N)nc(N)c1C#CC(C)c1ccc(nc1)-c1ccc(C)cc1
CCc1nc(N)nc(N)c1C#CC(C)c1cnc(nc1)-c1ccccc1
COC(=O)C[C@H](NC(=O)Nc1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(=O)OC |r|
COC(=O)CC[C@H](NC(=O)Nc1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(=O)OC |r|
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(NC(=O)NC(CC(O)=O)C(O)=O)cc1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(NC(=O)NC(CCC(O)=O)C(O)=O)cc1
COC(=O)CCC1NC(=O)N(C1=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1
Nc1nc2ncc(CNc3ccc(cc3)C(=O)NC(Cc3cnc[nH]3)C(O)=O)nc2c(=O)[nH]1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(Cc1cnc[nH]1)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(Cc1cn(CC(O)=O)cn1)C(O)=O
COc1cc(NCc2cnc3nc(N)nc(N)c3c2C)c(cc1OC)-n1cccc1
COc1ccc(cc1NCc1cnc2nc(N)nc(N)c2c1C)-c1ccccc1
COc1cccc2N(Cc3cnc4nc(N)nc(N)c4c3C)CCc12
Cc1c(C)c(c(C)c(C)c1NCc1cnc2nc(N)nc(N)c2c1C)-n1cccc1
COc1cc2CCN(Cc3cnc4nc(N)nc(N)c4c3C)c2cc1OC
COc1cc2CCN(Cc3cnc4nc(N)nc(N)c4c3C)Cc2cc1OC
COc1cc(c(OC)cc1NCc1cnc2nc(N)nc(N)c2c1C)-n1cccc1
COc1ccc2N(Cc3cnc4nc(N)nc(N)c4c3C)CCc2c1
COc1ccc2n(Cc3cnc4nc(N)nc(N)c4c3C)ccc2c1
CN(Cc1c[nH]c2nc(N)nc(N)c12)c1cccc2ccccc12
CN(Cc1c[nH]c2nc(N)nc(N)c12)c1ccc(Cl)c(Cl)c1
CN(Cc1c[nH]c2nc(N)nc(N)c12)c1ccc(cc1)C(=O)N(C)C(CCC(O)=O)C(O)=O
Nc1nc(N)c2c(CSc3cccc4ccccc34)c[nH]c2n1
COc1ccc(OC)c(c1)N(C)Cc1c[nH]c2nc(N)nc(N)c12
Nc1nc(N)c2c(CSc3ccc(Cl)c(Cl)c3)c[nH]c2n1
Nc1nc(N)c2c(CSc3ccc4ccccc4c3)c[nH]c2n1
COc1ccc(SCc2c[nH]c3nc(N)nc(N)c23)cc1OC
CN(CC1=Nc2c(N)nc(N)nc2NC1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r,t:3|
CN(CC1=Nc2c(N)nc(N)nc2N(C)C1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r,t:3|
CN(CC1CNc2nc(N)nc(N)c2N1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CCCCN1CC(CN(C)c2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=Nc2c(N)nc(N)nc12 |r,c:28|
CN(CC1=Nc2c(N)nc(N)nc2N(Cc2ccccc2)C1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r,t:3|
CN(CC1=Nc2c(N)nc(N)nc2N(CC2CCCCC2)C1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r,t:3|
CCN1CC(CN(C)c2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=Nc2c(N)nc(N)nc12 |r,c:26|
CCCCCCN1CC(CN(C)c2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=Nc2c(N)nc(N)nc12 |r,c:30|
CN(CC1CN(C)c2nc(N)nc(N)c2N1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CN(CC1=Nc2c(N)nc(N)nc2N(Cc2ccc(Cl)c(Cl)c2)C1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r,t:3|
CN(CC1=Nc2c(N)nc(N)nc2N(Cc2cccc3ccccc23)C1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r,t:3|
COc1ccc(-c2nc3nc(N)nc(N)c3[nH]2)c(OC)c1
COc1cc(OC)c(cc1OC)-c1nc2nc(N)nc(N)c2[nH]1
COc1cc(cc(OC)c1O)-c1nc2nc(N)nc(N)c2[nH]1
COc1cc(NCc2nc3nc(N)nc(N)c3[nH]2)cc(OC)c1OC
Nc1nc(N)c2[nH]c(nc2n1)-c1c(Cl)cccc1Cl
Nc1nc(N)c2[nH]c(nc2n1)-c1ccncc1
COc1cc(OC)c(-c2nc3nc(N)nc(N)c3[nH]2)c(OC)c1
Nc1nc(N)c2[nH]c(nc2n1)-c1ccc(Cl)c(Cl)c1
Nc1nc(N)c2[nH]c(nc2n1)-c1ccc2ccccc2c1
COc1cc(cc(OC)c1OC)-c1nc2nc(N)nc(N)c2[nH]1
COc1ccc(-c2nc3nc(N)nc(N)c3[nH]2)c(OC)c1OC
Nc1nc(N)c2[nH]c(CSc3ccc4ccccc4c3)nc2n1
COc1ccc(cc1OC)-c1nc2nc(N)nc(N)c2[nH]1
COc1cc(-c2nc3nc(N)nc(N)c3[nH]2)c(cc1OC)[N+]([O-])=O
Nc1nc(N)c2[nH]c(nc2n1)C1c2ccccc2-c2ccccc12
COc1ccc(-c2nc3nc(N)nc(N)c3[nH]2)c2ccccc12
COc1ccc(OC)c(NCc2nc3nc(N)nc(N)c3[nH]2)c1
COc1cc(OC)cc(c1)-c1nc2nc(N)nc(N)c2[nH]1
COc1ccc(OC)c(c1)-c1nc2nc(N)nc(N)c2[nH]1
Nc1nc(N)c2[nH]c(Cc3ccccc3)nc2n1
Nc1nc(N)c2[nH]c(nc2n1)-c1ccccc1
Nc1nc(N)c2[nH]c(nc2n1)-c1ccc(cc1)-c1ccccc1
CCc1nc(N)nc(N)c1-c1ccc(NCc2ccc(cc2)C(=O)N(C)C)c(c1)[N+]([O-])=O
CCc1nc(N)nc(N)c1-c1ccc(NCc2ccc(cc2)C(O)=O)c(c1)[N+]([O-])=O
CCc1nc(N)nc(N)c1-c1ccc(NCc2ccc(cc2)C(=O)N2CCCCC2)c(c1)[N+]([O-])=O
CCc1nc(N)nc(N)c1-c1ccc(NCc2ccc(cc2)S(N)(=O)=O)c(c1)[N+]([O-])=O
Cc1cn(CCC2CC(O)C(COP(O)(O)=O)O2)c(=O)[nH]c1=O
CCc1nc(N)nc(N)c1-c1ccc(NCc2ccccc2)c(c1)[N+]([O-])=O
CCc1nc(N)nc(N)c1-c1ccc(N(C)Cc2ccc(cc2)C2=NC(C)(C)CO2)c(c1)[N+]([O-])=O |t:25|
CCc1nc(N)nc(N)c1-c1ccc(NCc2ccc(cc2)C(=O)NC)c(c1)[N+]([O-])=O
CCc1nc(N)nc(N)c1-c1ccc(NCc2ccc(cc2)C(=O)NC(CCC(O)=O)C(O)=O)c(c1)[N+]([O-])=O
CCOC(=O)CCC(NC(=O)c1ccc(CNc2ccc(cc2[N+]([O-])=O)-c2c(N)nc(N)nc2CC)cc1)C(=O)OCC
CCc1nc(N)nc(N)c1-c1ccc(NCc2ccc(cc2)C2OCCO2)c(c1)[N+]([O-])=O
CCc1nc(N)nc(N)c1-c1ccc(NCc2ccc(cc2)C(N)=O)c(c1)[N+]([O-])=O
Cc1c(c(nc(n1)N)N)c2ccc(c(c2)Cl)Cl
CCc1nc(N)nc(N)c1-c1ccc(N(C)Cc2ccc(cc2)C(=O)OC)c(c1)[N+]([O-])=O
COc1ccc(cc1)N(C)c1ccc2nc(N)nc(N)c2n1
COc1cc(CNc2ccc3nc(N)nc(N)c3n2)cc(OC)c1OC
COc1ccc(Sc2ccc3nc(N)nc(N)c3n2)cc1
COc1ccc(Nc2ccc3nc(N)nc(N)c3n2)cc1
COc1cc(cc(OC)c1OC)N(C)c1ccc2nc(N)nc(N)c2n1
CN(c1ccccc1)c1ccc2nc(N)nc(N)c2n1
COc1ccc(OC)c(c1)N(C)c1ccc2nc(N)nc(N)c2n1
COc1ccc(OC)c(Nc2ccc3nc(N)nc(N)c3n2)c1
COc1ccc(cc1OC)S(=O)(=O)c1ccc2nc(N)nc(N)c2n1
COc1ccc(cc1OC)N(C)c1ccc2nc(N)nc(N)c2n1
COc1ccccc1Nc1ccc2nc(N)nc(N)c2n1
Nc1nc(N)c2nc(Nc3ccc(Cl)cc3)ccc2n1
COc1ccc(Sc2ccc3nc(N)nc(N)c3n2)cc1OC
COc1cc(Nc2ccc3nc(N)nc(N)c3n2)cc(OC)c1OC
COc1ccccc1Sc1ccc2nc(N)nc(N)c2n1
CN(c1ccc2nc(N)nc(N)c2n1)c1cccc2ccccc12
Nc1nc(N)c2nc(Nc3ccc4ccccc4c3)ccc2n1
COc1ccc(Nc2ccc3nc(N)nc(N)c3n2)cc1OC
COc1ccc(cc1)S(=O)(=O)c1ccc2nc(N)nc(N)c2n1
COc1ccccc1S(=O)(=O)c1ccc2nc(N)nc(N)c2n1
Nc1nc(N)c2nc(Nc3ccccc3)ccc2n1
C[C@](CCC(O)=O)(NC(=O)c1ccc(CCC2CNc3nc(N)nc(N)c3C2)o1)C(O)=O
C[C@](CCC(O)=O)(NC(=O)c1ccc(CCC2CNc3nc(N)nc(N)c3C2)cc1)C(O)=O
C[C@](CCC(O)=O)(NC(=O)c1ccc(CCC2CNc3nc(N)nc(N)c3C2)s1)C(O)=O
COc1cccc(CC2CCc3nc(N)nc(N)c3C2)c1
Cc1cccc(CC2CCc3nc(N)nc(N)c3C2)c1
COc1ccc(CC2CCc3nc(N)nc(N)c3C2)cc1OC
COc1ccccc1CC1CCc2nc(N)nc(N)c2C1
Nc1nc(N)c2CC(Cc3ccccc3)CCc2n1
Nc1nc(N)c2CC(Cc3ccc(OC(F)(F)F)cc3)CCc2n1
CC(C)(C)C1CCc2nc(N)nc(N)c2C1
Cc1ccccc1CC1CCc2nc(N)nc(N)c2C1
Nc1nc(N)c2CC(Cc3ccsc3)CCc2n1
COc1ccc(OC)c(CN2CCc3nc(N)nc(N)c3C2)c1
CCC1CCc2nc(N)nc(N)c2C1
Nc1nc(N)c2CC(Cc3cccc(c3)C(F)(F)F)CCc2n1
Nc1nc(N)c2CC(CC3CCCO3)CCc2n1
Nc1nc(N)c2CC(CCc2n1)c1ccccc1
COc1ccc(CC2CCc3nc(N)nc(N)c3C2)cc1
Nc1nc(N)c2CC(Cc3ccc(Cl)c(Cl)c3)CCc2n1
COc1ccc(OC)c(CC2CCc3nc(N)nc(N)c3C2)c1
Nc1nc(N)c2CC(Cc3cccs3)CCc2n1
Nc1nc(N)c2CC(Cc3cccc(OC(F)(F)F)c3)CCc2n1
COc1cc(CN2CCc3nc(N)nc(N)c3C2)cc(OC)c1OC
COc1cc(CC2CCc3nc(N)nc(N)c3C2)cc(OC)c1OC
COc1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2c1C
COc1ccccc1NCc1cnc2nc(N)nc(N)c2c1C
Cc1c(CNc2ccccc2Cl)cnc2nc(N)nc(N)c12
COc1ccc(NCc2cnc3nc(N)nc(N)c3c2C)cc1
CN(Cc1cnc2nc(N)nc(N)c2c1C)c1ccc(Br)cc1
Cc1c(CNc2cccc(Cl)c2)cnc2nc(N)nc(N)c12
COc1cccc(c1)N(C)Cc1cnc2nc(N)nc(N)c2c1C
CN(Cc1cnc2nc(N)nc(N)c2c1C)c1ccc(Cl)cc1
COc1cccc(NCc2cnc3nc(N)nc(N)c3c2C)c1
CN(Cc1cnc2nc(N)nc(N)c2c1C)c1ccccc1Cl
Cc1c(CNc2ccccc2)cnc2nc(N)nc(N)c12
Cc1c(CNc2ccc(Br)cc2)cnc2nc(N)nc(N)c12
CCCCCCCOc1cccc(Cc2c(N)nc(N)nc2CC)c1
CCCCCCCOc1cccc(Cc2c(C)nc(N)nc2N)c1
CCCCCCCCCCOc1cccc(Cc2cnc(N)nc2N)c1
CCCCCOc1cccc(Cc2cnc(N)nc2N)c1
Nc1ncc(Cc2cccc(OC3CCCCO3)c2)c(N)n1
CCCOc1ccc(Cc2cnc(N)nc2N)cc1
CCOc1cccc(Cc2cnc(N)nc2N)c1
CCCOc1cccc(Cc2cnc(N)nc2N)c1
CCOc1ccc(Cc2cnc(N)nc2N)cc1
CC(C)Oc1cccc(Cc2cnc(N)nc2N)c1
CCCCCCCCCOc1cccc(Cc2cnc(N)nc2N)c1
Nc1nc(N)c2nc(CN(c3ccccc3)c3ccccc3)cnc2n1
Nc1nc(N)c2nc(CN3c4ccccc4Sc4ccccc34)cnc2n1
Nc1nc(N)c2nc(CN3c4ccccc4CCc4ccccc34)cnc2n1
Nc1nc(N)c2nc(CN3c4ccccc4Cc4ccccc34)cnc2n1
Nc1nc(N)c2nc(CN3c4ccccc4Oc4ccccc34)cnc2n1
Nc1nc(N)c2nc(Cn3c4ccccc4c4ccccc34)cnc2n1
Nc1nc(N)c2cc(COC(=O)c3ccccc3)cnc2n1
Nc1nc(N)c2cc(COC(=O)c3ccccc3)ccc2n1
Nc1nc(N)c2cc(CNc3ccccc3)ccc2n1
Cc1c(COC(=O)c2ccccc2)cnc2nc(N)nc(N)c12
Nc1nc(N)c2cc(COC(=O)Cc3ccccc3)ccc2n1
COc1ccc(C(=O)OCc2ccc3nc(N)nc(N)c3c2)c(OC)c1OC
Nc1nc(N)c2nc(COC(=O)c3ccccc3)cnc2n1
CN(Cc1ccc2nc(N)nc(N)c2c1)c1ccccc1
Nc1nc(N)c2cc(ccc2n1)C(=O)OCc1ccccc1
COc1ccc(cc1OC)C(=O)OCc1ccc2nc(N)nc(N)c2c1
Cc1c(CO)cnc2nc(N)nc(N)c12
Nc1nc(N)c2cc(CO)ccc2n1
COc1cc(OC)cc(c1)C(=O)OCc1ccc2nc(N)nc(N)c2c1
Nc1nc(N)c2cc(\C=C\C(=O)Oc3ccccc3)ccc2n1
COc1cc(cc(OC)c1OC)C(=O)OCc1ccc2nc(N)nc(N)c2c1
Nc1nc(N)c2cc(COC(=O)c3ccc(cc3)C(O)=O)ccc2n1
COc1ccc(OC)c(c1)C(=O)OCc1ccc2nc(N)nc(N)c2c1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCO)[C@H](C)c1ccccc1 |r|
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCCO)Cc1ccccc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccc(OC)c(OC)c1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccccc1C
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccncc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccc(cc1)C(F)(F)F
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCO)[C@@H](C)c1ccccc1 |r|
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1cc(OC)cc(OC)c1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCO)CCc1ccccc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1cc(OC)c(OC)c(OC)c1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1cccc2ccccc12
CCc1nc(N)nc(N)c1-c1ccc(Cl)c([N-]N=[N+](CCOC(C)=O)Cc2cccc(c2)[N+]([O-])=O)c1 |w:17.17|
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1cccc(C)c1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccc(Cl)cc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c([N-]N=[N+](CCOC(C)=O)Cc2ccc(cc2)[N+]([O-])=O)c1 |w:17.17|
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(=O)c1ccccc1)Cc1ccccc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccc(F)cc1
CCC(=O)OCCN(Cc1ccccc1)\N=N\c1cc(ccc1Cl)-c1c(N)nc(N)nc1CC
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(=O)C(C)C)Cc1ccccc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccc(C)cc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1cccc(F)c1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1cccc(Cl)c1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccc(OC)cc1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccccc1F
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccc2ccccc2c1
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N(CCOC(C)=O)Cc1ccccc1Cl
Cc1c(CNc2ccc(Cl)c3ccccc23)cnc2nc(N)nc(N)c12
COc1cc(CCc2cnc3nc(N)nc(N)c3c2C)cc(OC)c1
Cc1c(CNC2c3ccccc3-c3ccccc23)cnc2nc(N)nc(N)c12
COc1cc(SCc2cnc3nc(N)nc(N)c3c2C)cc(OC)c1OC
Cc1c(CNc2ccc3-c4ccccc4-c4cccc2c34)cnc2nc(N)nc(N)c12
Cc1c(CNc2ccc3ncccc3c2)cnc2nc(N)nc(N)c12
Cc1c(CNc2cnc3ccccc3c2)cnc2nc(N)nc(N)c12
Cc1c(Cl)cccc1NCc1cnc2nc(N)nc(N)c2c1C
Cc1c(CNc2cc(ccc2F)C(F)(F)F)cnc2nc(N)nc(N)c12
COCc1c(CNc2cc(OC)ccc2OC)cnc2nc(N)nc(N)c12
Cc1c(CNc2cc(Br)ccc2Br)cnc2nc(N)nc(N)c12
COCc1c(CNc2ccc(OC)c(OC)c2)cnc2nc(N)nc(N)c12
COCc1c(CNc2cc(OC)c(OC)c(OC)c2)cnc2nc(N)nc(N)c12
Cc1cc(C)c(NCc2cnc3nc(N)nc(N)c3c2C)c(Cl)c1
CCc1c(CNc2cc(ccc2OC)C(F)(F)F)cnc2nc(N)nc(N)c12
COc1ccc(OC)c(SCc2cnc3nc(N)nc(N)c3c2C)c1
Cc1ccc(NCc2cnc3nc(N)nc(N)c3c2C)cc1Br
Cc1c(CNc2cc(ccc2Br)C(F)(F)F)cnc2nc(N)nc(N)c12
CCCOc1ccc(OCCC)c(NCc2cnc3nc(N)nc(N)c3c2C)c1
Cc1c(CNc2ccc-3c(Cc4ccccc-34)c2)cnc2nc(N)nc(N)c12
COCc1c(CNc2ccc(Cl)cc2)cnc2nc(N)nc(N)c12
CCc1c(CNc2cc(OC)ccc2OC)cnc2nc(N)nc(N)c12
COc1cc(ccc1NCc1cnc2nc(N)nc(N)c2c1C)-c1ccccc1
Cc1cc(NCc2cnc3nc(N)nc(N)c3c2C)ccc1Br
Cc1c(CNc2cc(Cl)ccc2Cl)cnc2nc(N)nc(N)c12
Cc1c(CNc2cc(F)ccc2F)cnc2nc(N)nc(N)c12
Cc1c(CNc2ccc3ccccc3c2)cnc2nc(N)nc(N)c12
Cc1c(CNC2CCCc3ccccc23)cnc2nc(N)nc(N)c12
Cc1ccc(F)c(NCc2cnc3nc(N)nc(N)c3c2C)c1
Cc1cc(Br)ccc1NCc1cnc2nc(N)nc(N)c2c1C
Cc1cc(Br)cc(C)c1NCc1cnc2nc(N)nc(N)c2c1C
Cc1c(CNc2ccc3ccc4cccc5ccc2c3c45)cnc2nc(N)nc(N)c12
CCOc1ccc(NCc2cnc3nc(N)nc(N)c3c2C)cc1OC
Cc1cc(Cl)ccc1NCc1cnc2nc(N)nc(N)c2c1C
Cc1ccc(NCc2cnc3nc(N)nc(N)c3c2C)cc1Cl
Cc1c(cnc2c1c(nc(n2)N)N)CNc3cccc4c3cccn4
COc1ccc(NCc2cnc3nc(N)nc(N)c3c2C)cc1F
COc1cc(Cl)c(C)cc1NCc1cnc2nc(N)nc(N)c2c1C
CCc1c(CNc2cc(C)ccc2OC)cnc2nc(N)nc(N)c12
CCCOc1ccc(NCc2cnc3nc(N)nc(N)c3c2C)cc1OC
Cc1ccc(F)cc1NCc1cnc2nc(N)nc(N)c2c1C
Cc1ccc(Cl)c(NCc2cnc3nc(N)nc(N)c3c2C)c1
Cc1c(CNc2ccc(OC(F)F)cc2)cnc2nc(N)nc(N)c12
Cc1ccc(Cl)cc1NCc1cnc2nc(N)nc(N)c2c1C
Cc1cc(NCc2cnc3nc(N)nc(N)c3c2C)c(Cl)cc1F
Cc1c(CNc2c3ccccc3cc3ccccc23)cnc2nc(N)nc(N)c12
Cc1c(CNc2ccccc2OC(F)F)cnc2nc(N)nc(N)c12
Cc1c(CNc2cccc3cnccc23)cnc2nc(N)nc(N)c12
COc1ccc(OCCCCCC(O)=O)cc1Cc1cnc(N)nc1N
CCCCCCCOc1ccc(OC)c(Cc2cnc(N)nc2N)c1
COc1ccc(OCCCCCCC(O)=O)cc1Cc1cnc(N)nc1N
CCCCCCCCOc1ccc(OC)c(Cc2cnc(N)nc2N)c1
CCCCCCCCCOc1ccc(OC)c(Cc2cnc(N)nc2N)c1
CCCCCCOc1ccc(OC)c(Cc2cnc(N)nc2N)c1
COc1ccc(OCCCCCCCCC(O)=O)cc1Cc1cnc(N)nc1N
COc1ccc(OCCCC(O)=O)cc1Cc1cnc(N)nc1N
COc1ccc(OCCCCCCCC(O)=O)cc1Cc1cnc(N)nc1N
CCCCCOc1ccc(OC)c(Cc2cnc(N)nc2N)c1
CCCCCCc1nc(N)nc(N)c1-c1ccccc1
COc1ccc(CCCc2nc(N)nc(N)c2-c2cccc(Cl)c2)cc1
Nc1cc(N)c2nc(CCc3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccccc3C(O)=O)C(O)=O)cnc2c1
Nc1cc(N)c2cc(CCc3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccccc3C(O)=O)C(O)=O)ccc2c1
Nc1cc(N)c2nc(CC(CC#C)c3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccccc3C(O)=O)C(O)=O)cnc2c1
Nc1cc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccccc3C(O)=O)C(O)=O)cnc2c1
CCC(Cc1cnc2cc(N)cc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCNC(=O)c1ccccc1C(O)=O)C(O)=O
CC(Cc1coc2nc(N)cc(N)c12)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CCC(Cc1coc2nc(N)cc(N)c12)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1cc(N)c2c(CCc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)coc2n1
COc1ccc(cc1Cc1cnc(N)nc1N)C#CCOc1ccccc1C(O)=O
COc1ccc(CCCCCCC(O)=O)cc1Cc1cnc(N)nc1N
COc1ccc(CCCCC(O)=O)cc1Cc1cnc(N)nc1N
COc1ccc(OCc2cccc(c2)C(O)=O)cc1Cc1cnc(N)nc1N
COc1ccc(cc1Cc1cnc(N)nc1N)C#CCCC(O)=O
COc1ccc(cc1Cc1cnc(N)nc1N)C#CCOc1cccc(c1)C(O)=O
COc1ccc(OCc2ccc(cc2)C(O)=O)cc1Cc1cnc(N)nc1N
COc1cc2CCN(Cc3cnc(N)nc3N)[C@@H](C)c2c2OCOc12
COc1cc2CCN(Cc3cnc(N)nc3N)C(C)c2cc1OC
CSc1c2CN(Cc3cnc(N)nc3N)CCn2c2cc(Cl)ccc12
CC1N(Cc2cnc(N)nc2N)CCn2c1cc(Cc1ccccc1)c2-c1ccccc1
COc1cc2CN(Cc3cnc(N)nc3N)CC(c3ccc(Cl)cc3Cl)c2cc1OC
CC1N(Cc2cnc(N)nc2N)CCc2c1ccc1c3ccccc3n(C)c21
COc1cc2CCN(Cc3cnc(N)nc3N)[C@H](C)c2c2OCOc12
COc1cc2CCN(Cc3cnc(N)nc3N)Cc2cc1OC
COc1ccc2C(CN(Cc3cnc(N)nc3N)Cc2c1)c1cccc(c1)[N+]([O-])=O
COc1cc2CCN(Cc3cnc(N)nc3N)C(C)c2c2OCOc12
Nc1ncc(CN2CCc3ccccc3C2)c(N)n1
Nc1ncc(CN2CCc3c(C2)[nH]c2ccccc32)c(N)n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)NCCCCCCCCCCCCNC(=O)CCC(NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CC(O)=O)C(O)=O
Nc1nc(N)c2cc(CNc3ccc4ccccc4c3)cnc2n1
Nc1nc(N)c2cc(CNc3ccccc3)cnc2n1
Nc1nc(N)c2cc(CNc3ccc(Cl)c(Cl)c3)cnc2n1
COc1ccc(NCc2cnc3nc(N)nc(N)c3c2)cc1OC
CN(Cc1cnc2nc(N)nc(N)c2c1)c1ccc(Cl)c(Cl)c1
CN(Cc1cnc2nc(N)nc(N)c2c1)c1ccccc1
c1cc(c(cc1Cl)NCc2cc3c(nc(nc3nc2)N)N)Cl
COc1ccc(OC)c(NCc2cnc3nc(N)nc(N)c3c2)c1
COc1cccc(NCc2cnc3nc(N)nc(N)c3c2)c1
CN(Cc1cnc2nc(N)nc(N)c2c1)c1cc(Cl)c(Cl)c(Cl)c1
Nc1nc(N)c2cc(CNc3cc(Cl)c(Cl)c(Cl)c3)cnc2n1
Cc1ccc(Cl)cc1Cc1cnc2nc(N)nc(N)c2c1C
COc1ccc(cc1Cc1cnc(N)nc1N)C#Cc1cccc(c1)C(O)=O
COc1ccc(\C=C\COc2ccccc2C(O)=O)cc1Cc1cnc(N)nc1N
COc1cc(Cc2cnc3nc(N)nc(N)c3c2C)cc(OC)c1
COc1ccc(CCCOc2cccc(c2)C(O)=O)cc1Cc1cnc(N)nc1N
COc1ccc(CCc2ccc(cc2)C(O)=O)cc1Cc1cnc(N)nc1N
COc1ccc(CCCOc2ccccc2C(O)=O)cc1Cc1cnc(N)nc1N
COc1ccc(cc1Cc1cnc(N)nc1N)C#Cc1ccccc1C(O)=O
Nc1nc(N)c2nc(CN3c4ccccc4C=Cc4cc(O)ccc34)cnc2n1 |c:17|
Nc1nc(N)c2nc(CN3c4ccccc4C=Cc4cc(OCc5ccc(cc5)C(O)=O)ccc34)cnc2n1 |c:17|
Nc1nc(N)c2nc(CN3c4ccccc4C=Cc4cc(OCCC(O)=O)ccc34)cnc2n1 |c:17|
c1ccc2c(c1)C=Cc3cc(ccc3N2Cc4cnc5c(n4)c(nc(n5)N)N)OCCCC(=O)O
CCCOc1cc(NCc2cnc3nc(N)nc(N)c3c2C)cc(OCCC)c1
Nc1nc(N)c2nc(CSc3ccc(Sc4ccccc4)cc3)cnc2n1
Nc1nc(N)c2nc(CN3c4ccccc4C=Cc4cc(OCCCCC(O)=O)ccc34)cnc2n1 |c:17|
Nc1nc(N)c2nc(CN3c4ccccc4C=Cc4cc(OCC(O)=O)ccc34)cnc2n1 |c:17|
COc1ccccc1Sc1[nH]c2nc(N)nc(N)c2c1C
COc1cccc(Sc2[nH]c3nc(N)nc(N)c3c2C)c1
Cc1c(Sc2ccc(Cl)cc2Cl)[nH]c2nc(N)nc(N)c12
Cc1c(Sc2cccc3ccccc23)[nH]c2nc(N)nc(N)c12
Nc1nc2[nH]cc(Cc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c2c(=O)[nH]1 |r|
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc2C(=O)N(Cc2c1)[C@@H](CCC(O)=O)C(O)=O |r|
Nc1nc(N)c2nc(CNc3ccc4C(=O)N(Cc4c3)[C@@H](CCC(O)=O)C(O)=O)cnc2n1 |r|
Nc1nc(N)c2nc(CNc3ccc4C(=O)N(Cc4c3)C(CCC(O)=O)C(O)=O)cnc2n1
Nc1nnc(Sc2nc3ccc(Cl)cc3c(=O)n2-c2ccc(Cl)cc2)s1
Nc1nnc(Sc2nc3ccc(Cl)cc3c(=O)n2-c2ccc(Oc3ccccc3)cc2)s1
COc1cc2nc(Sc3nnc(N)s3)n(-c3ccccc3)c(=O)c2cc1OC
COc1cc2nc(Sc3nnc(N)s3)n(-c3ccc(C)cc3)c(=O)c2cc1OC
COc1ccc(cc1)-n1c(Sc2nnc(N)s2)nc2ccc(C)cc2c1=O
COc1ccc(cc1)-n1c(Sc2nnc(N)s2)nc2cc(OC)c(OC)cc2c1=O
COc1cc2nc(Sc3nnc(N)s3)n(-c3ccc(Cl)cc3)c(=O)c2cc1OC
Cc1nc(N)sc1Sc1nc2ccc(C)cc2c(=O)n1-c1ccc(Oc2ccccc2)cc1
Cc1nc(N)sc1Sc1nc2ccc(C)cc2c(=O)n1-c1ccc(Cl)cc1
COc1ccc(cc1)-n1c(Sc2nnc(N)s2)nc2ccc(Cl)cc2c1=O
Cc1ccc2nc(Sc3nnc(N)s3)n(-c3ccc(Cl)cc3)c(=O)c2c1
Cc1ccc2nc(Sc3nnc(N)s3)n(-c3ccc(Oc4ccccc4)cc3)c(=O)c2c1
Nc1nnc(Sc2nc3ccc(Cl)cc3c(=O)n2-c2ccccc2)s1
Cc1ccc(cc1)-n1c(Sc2nnc(N)s2)nc2ccc(Cl)cc2c1=O
COc1cc2nc(Sc3nnc(N)s3)n(-c3ccc(Oc4ccccc4)cc3)c(=O)c2cc1OC
Cc1nc(N)sc1Sc1nc2ccc(C)cc2c(=O)n1-c1ccccc1
COc1cc2nc(Sc3sc(N)nc3C)n(Cc3ccccc3)c(=O)c2cc1OC
Cc1ccc2nc(Sc3cnc(N)s3)n(-c3ccccc3)c(=O)c2c1
COc1cc2nc(Sc3cnc(N)s3)n(-c3ccccc3)c(=O)c2cc1OC
CCOC(=O)c1nc(N)sc1Sc1nc2cc(OC)c(OC)cc2c(=O)n1-c1ccccc1
Nc1nnc(Sc2nc3ccc(Cl)cc3c(=O)n2Cc2ccccc2)s1
COc1cc2nc(Sc3nnc(N)s3)n(Cc3ccccc3)c(=O)c2cc1OC
Cc1nc(N)sc1Sc1nc2ccc(C)cc2c(=O)n1Cc1ccccc1
Cc1nc(N)sc1Sc1nc2ccc(C)cc2c(=O)n1-c1ccc(C)cc1
Cc1nc(N)sc1Sc1nc2ccc(Cl)cc2c(=O)n1Cc1ccccc1
COc1ccc(cc1)-n1c(Sc2sc(N)nc2C)nc2ccc(C)cc2c1=O
COc1cc2nc(Sc3sc(N)nc3C)n(-c3ccc(Cl)cc3)c(=O)c2cc1OC
Cc1ccc(cc1)-n1c(Sc2nnc(N)s2)nc2ccc(C)cc2c1=O
Cc1ccc2nc(Sc3nnc(N)s3)n(-c3ccccc3)c(=O)c2c1
COc1cc2nc(Sc3sc(N)nc3C)n(-c3ccc(Oc4ccccc4)cc3)c(=O)c2cc1OC
Cc1ccc2nc(Sc3nnc(N)s3)n(Cc3ccccc3)c(=O)c2c1
COc1cc2nc(Sc3sc(N)nc3C)n(-c3ccccc3)c(=O)c2cc1OC
COc1cc2nc(Sc3sc(N)nc3C)n(-c3ccc(C)cc3)c(=O)c2cc1OC
COc1ccc(cc1)-n1c(Sc2sc(N)nc2C)nc2cc(OC)c(OC)cc2c1=O
COc1ccc(cc1)-n1c(Sc2sc(N)nc2C)nc2ccc(Cl)cc2c1=O
Cc1nc(N)sc1Sc1nc2ccc(Cl)cc2c(=O)n1-c1ccc(Cl)cc1
Cc1nc(N)sc1Sc1nc2ccc(Cl)cc2c(=O)n1-c1ccccc1
Cc1nc(N)sc1Sc1nc2ccc(Cl)cc2c(=O)n1-c1ccc(Oc2ccccc2)cc1
Cc1nc(N)sc1Sc1nc2ccc(Cl)cc2c(=O)n1-c1ccc(C)cc1
COc1cc(\C=C2/CCCc3c2nc(N)nc3-c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC
COc1ccc(\C=C2/CCCc3c2nc(N)nc3-c2ccc(OC)c(OC)c2)cc1OC
COc1cc(\C=C2/CCCc3c2nc(C)nc3-c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC
COc1ccc(\C=C2/CCCc3c2nc(C)nc3-c2ccc(OC)c(OC)c2)cc1OC
Nc1nc(N)c2cc(NCc3cccc4ccccc34)ccc2n1
CN(Cc1cnc2nc(N)nc(N)c2c1C)c1ccccc1
COc1cc(cc(OC)c1OC)N1Cc2cnc3nc(N)nc(N)c3c2C=C1 |c:29|
COc1ccc(cc1NNCc1cnc2nc(N)nc(N)c2c1C)-c1ccccc1
CN(Cc1cccc2ccccc12)c1ccc2nc(N)nc(N)c2c1
COc1cc(OC)c(CN(C)c2ccc3nc(N)nc(N)c3c2)c(OC)c1
Cc1c(C)c(c(C)c(C)c1NNCc1cnc2nc(N)nc(N)c2c1C)-n1cccc1
COCc1cc(cc(COC)c1COC)N(C)CC1CCc2nc(N)nc(N)c2C1
COc1cc(NCc2cnc3nc(N)nc(N)c3c2C)c(O)cc1-n1cccc1
Nc1nc(N)c2CC(CNc3cccc(Cl)c3)CCc2n1
COc1cc(NNCc2cnc3nc(N)nc(N)c3c2C)c(cc1OC)-n1cccc1
CCc1c(c(nc(n1)N)N)C#C[C@H](C)c2cc(cc(c2)OC)N3CCOCC3
COc1cc(cc(c1)N1CCNCC1)C(C)C#Cc1c(C)nc(N)nc1N
CCc1nc(N)nc(N)c1C#CC(C)c1cc(ccc1OC)-c1cc[n+]([O-])cc1
COc1ccc(Nc2nc3cc(N)cc(N)c3nc2-c2ccccc2)cc1
COc1cc(Nc2nc3cc(N)cc(N)c3nc2-c2ccccc2)cc(OC)c1
COc1cc(Nc2nc3cc(N)cc(N)c3nc2-c2ccccc2)cc(OC)c1OC
Nc1nc(N)c2c(COc3ccc(F)cc3F)cccc2n1
Nc1nc(N)c2c(COc3ccccc3F)cccc2n1
Nc1nc(N)c2c(OCC3CCN(Cc4cccc(Cl)c4)CC3)cccc2n1
Nc1nc(N)c2c(OCC3CCN(CC3)C(=O)c3cccc(Cl)c3)cccc2n1
C[C@@H](c1cccc(c1)Cl)Oc2cccc3c2c(nc(n3)N)N
Nc1nc(N)c2c(OCC3CCN(CC3)S(=O)(=O)c3ccccc3F)cccc2n1
Nc1nc(N)c2c(OCC3CCN(CC3)C(=O)c3ccccc3Cl)cccc2n1
c1ccc(c(c1)CN2CCC(CC2)COc3cccc4c3c(nc(n4)N)N)F
Nc1nc(N)c2c(COc3cccc(Cl)c3)cccc2n1
Nc1nc(N)c2c(OCc3ccccc3F)cccc2n1
Nc1nc(N)c2c(OCc3cccc(Cl)c3)cccc2n1
C[C@H](Oc1cccc2nc(N)nc(N)c12)c1cccc(Cl)c1
c1cc(ccc1C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC[C@@H]2CCc3c(c(nc(n3)N)N)N2
Nc1nc(N)c2N(CC=C)C(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)CCc2n1
Nc1nc(N)c2N(CC=C)C(CNc3ccc(cc3Br)C(=O)NC(CCC(O)=O)C(O)=O)CCc2n1
Nc1nc(N)c2N(CC(Br)CBr)C(CNc3ccc(cc3Br)C(=O)NC(CCC(O)=O)C(O)=O)CCc2n1
Nc1nc(N)c2N(CC=C)C(CN(CC=C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)CCc2n1
Cc1nc2cc(Nc3nc(Nc4ccc(F)cc4)nc(n3)N3CCCC3)ccc2n1Cc1ccccc1
CN1CCN(CC1)c1nc(Nc2ccc(F)cc2)nc(Nc2ccc3n(Cc4ccccc4)c(C)nc3c2)n1
Cc1nc2cc(Nc3nc(Nc4ccc(F)cc4)nc(n3)-c3ccc(Cl)cc3)ccc2n1Cc1ccccc1
Cc1nc2ccc(Nc3nc(Cl)nc(Nc4ccc(F)cc4)n3)cc2n1Cc1ccccc1
Cc1nc2ccc(Nc3nc(NCCN4CCOCC4)nc(Nc4ccc(F)cc4)n3)cc2n1Cc1ccccc1
COc1ccc(cc1)-c1nc(Nc2ccc(F)cc2)nc(Nc2ccc3n(Cc4ccccc4)c(C)nc3c2)n1
Cc1nc2cc(Nc3nc(Nc4ccc(F)cc4)nc(n3)-c3cccs3)ccc2n1Cc1ccccc1
Nc1nc(N)c2c3ccn(Cc4ccc(cc4)C#N)c3ccc2n1
Cc1cccc(Oc2ccc(cc2)-c2nc(N)nc(N)n2)c1C
Nc1ncc(CCCCc2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c(N)n1
Nc1ncc(CCCc2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c(N)n1
COc1cc(\C=C2/C(=O)Nc3ccccc23)cc(OC)c1O
CC1=NN(C(=O)\C1=C/c1cn(CC(O)Cn2cc(\C=C3\C(C)=NN(C3=O)c3cccc(Cl)c3)c3ccccc23)c2ccccc12)c1cccc(Cl)c1 |c:22,t:1|
[#6]-[#7]-1-[#6](=O)-[#7](-[#6])-[#6](=O)\[#6](=[#6]/c2cn(-[#6]-[#6](-[#8])-[#6]-n3cc(\[#6]=[#6]-4/[#6](=O)-[#7](-[#6])-[#6](=O)-[#7](-[#6])-[#6]-4=O)c4ccccc34)c3ccccc23)-[#6]-1=O
[#8]-[#6](-[#6]-n1cc(\[#6]=[#6]-2/[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)c2ccccc12)-[#6]-n1cc(\[#6]=[#6]-2/[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)c2ccccc12
[#8]-[#6](-[#6]-n1cc(\[#6]=[#6]-2/[#6](=O)-[#7]-[#6](=O)-[#7]-[#6]-2=O)c2ccccc12)-[#6]-n1cc(\[#6]=[#6]-2/[#6](=O)-[#7]-[#6](=O)-[#7]-[#6]-2=O)c2ccccc12
OC(Cn1cc(\C=C2/C(=O)N(c3ccccc23)c2c(Cl)cccc2Cl)c2ccccc12)Cn1cc(\C=C2/C(=O)N(c3ccccc23)c2c(Cl)cccc2Cl)c2ccccc12
OC(Cn1cc(\C=C2/C(=O)Nc3ccc(cc23)[N+]([O-])=O)c2ccccc12)Cn1cc(\C=C2/C(=O)Nc3ccc(cc23)[N+]([O-])=O)c2ccccc12
OC(Cn1cc(\C=C2/C(=O)Nc3ccccc23)c2ccccc12)Cn1cc(\C=C2/C(=O)Nc3ccccc23)c2ccccc12
Nc1ccc2NC(=O)\C(=C/c3cn(CC(O)Cn4cc(\C=C5/C(=O)Nc6ccc(N)cc56)c5ccccc45)c4ccccc34)c2c1
CC1(C)N=C(N)N=C(N)N1c1ccccc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1OCc1ccccc1 |t:3,6|
O=C(\C=C\c1ccccc1)c1ccccc1
CC1(C)N=C(N)N=C(N)N1c1ccc(C=CC(=O)c2ccccc2)cc1
CC1(C)N=C(N)N=C(N)N1c1cccc(C=CC(=O)c2ccccc2)c1
CC1(C)N=C(N)N=C(N)N1c1ccc(cc1)C(=O)C=Cc1ccccc1
CC1(C)N=C(N)N=C(N)N1c1cccc(c1)C(=O)C=Cc1ccccc1
CCC1N(N=Cc2ccccc12)C(=O)\C=C\c1cc(Cc2cnc(N)nc2N)cc(OC)c1OC |c:4|
COc1cc(Cc2cnc(N)nc2N)cc(\C=C\C(=O)N2N=Cc3ccccc3C2c2ccc(C)cc2)c1OC |c:22|
COc1cc(Cc2cnc(N)nc2N)cc(\C=C\C(=O)N2N=Cc3ccccc3C2C2CCCCC2)c1OC |c:22|
COc1cc(Cc2cnc(N)nc2N)cc(\C=C\C(=O)N2N=Cc3ccccc3C2C2CCCC2)c1OC |c:22|
COc1cc(Cc2cnc(N)nc2N)cc(\C=C\C(=O)N2N=Cc3ccccc3C2c2ccccc2)c1OC |c:22|
COC(=O)C(C)(C)C1N(N=Cc2ccccc12)C(=O)\C=C\c1cc(Cc2cnc(N)nc2N)cc(OC)c1OC |c:9|
COc1cc(Cc2cnc(N)nc2N)cc(\C=C\C(=O)N2N=Cc3ccccc3C2CCCO)c1OC |c:22|
CCCCC1N(N=Cc2ccccc12)C(=O)\C=C\c1cc(Cc2cnc(N)nc2N)cc(OC)c1OC |c:6|
CCCC1N(N=Cc2ccccc12)C(=O)\C=C\c1cc(Cc2cnc(N)nc2N)cc(O)c1OC |c:5|
COc1cc(Cc2cnc(N)nc2N)cc(\C=C\C(=O)N2N=Cc3ccccc3C2c2ccccc2)c1OCCN1CCOCC1 |c:22|
COc1cc(Cc2cnc(N)nc2N)cc(\C=C\C(=O)N2N=Cc3ccccc3C2c2ccc(CO)cc2)c1O |c:22|
COc1cc(Cc2cnc(N)nc2N)cc(\C=C\C(=O)N2N=Cc3ccccc3C2c2ccccc2CN(C)C)c1OC |c:22|
COc1ncc(C2N(N=Cc3ccccc23)C(=O)\C=C\c2cc(Cc3cnc(N)nc3N)cc(OC)c2OC)c(OC)n1 |c:8|
COc1cc(Cc2cnc(N)nc2N)cc(\C=C\C(=O)N2N=Cc3ccccc3C2c2ccc(CO)cc2)c1OC |c:22|
COc1cc(Cc2cnc(N)nc2N)cc(CCC(=O)N2N=Cc3ccccc3C2C)c1OC |c:22|
CCc1nc(N)nc(N)c1C#CCc1cc(ccc1OC)-c1cccc(c1)C(O)=O
CCc1nc(N)nc(N)c1C#C[C@H](C)c1cc(ccc1OC)-c1ccc(cc1)C(O)=O
COc1cc(CSc2nc3ccc(Cl)cc3c(=O)n2-c2ccccc2OC)cc(OC)c1OC |(158.73,-73.75,;157.39,-72.98,;157.39,-71.44,;156.05,-70.67,;156.05,-69.14,;154.72,-68.37,;154.71,-66.83,;153.37,-66.07,;152.04,-66.84,;150.7,-66.07,;149.37,-66.85,;148.04,-66.08,;148.04,-64.54,;146.7,-63.77,;149.37,-63.77,;150.7,-64.53,;152.03,-63.76,;152.02,-62.22,;153.37,-64.52,;154.69,-63.74,;156.03,-64.51,;157.36,-63.73,;157.35,-62.19,;156,-61.43,;154.68,-62.21,;153.34,-61.45,;153.32,-59.91,;157.37,-68.36,;158.71,-69.12,;160.04,-68.34,;160.03,-66.8,;158.72,-70.66,;160.06,-71.43,;161.39,-70.65,)|
COc1ccc(cc1)-n1c(SCc2cc(OC)c(OC)c(OC)c2)nc2cc(OC)c(OC)cc2c1=O
COc1cc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccc(C)cc2)cc(OC)c1OC
COc1ccc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2Cc2ccccc2)cc1
COc1ccc(CSc2nc3ccc(C)cc3c(=O)n2-c2ccc(OC)cc2OC)cc1 |(149.6,-11.83,;148.27,-12.61,;146.93,-11.84,;145.6,-12.62,;144.27,-11.85,;144.27,-10.31,;142.93,-9.55,;142.92,-8.01,;141.59,-7.25,;140.25,-8.02,;138.92,-7.25,;137.58,-8.03,;136.25,-7.26,;136.25,-5.72,;134.92,-4.95,;137.58,-4.94,;138.92,-5.71,;140.24,-4.94,;140.23,-3.4,;141.58,-5.7,;142.9,-4.92,;144.24,-5.69,;145.57,-4.91,;145.56,-3.37,;146.89,-2.59,;148.23,-3.35,;144.21,-2.61,;142.89,-3.39,;141.55,-2.63,;141.54,-1.09,;145.59,-9.54,;146.92,-10.3,)|
COc1ccc(c(OC)c1)-n1c(SCc2cc(OC)c(OC)c(OC)c2)nc2cc(OC)c(OC)cc2c1=O |(190.64,-55.1,;189.3,-54.34,;187.97,-55.12,;187.98,-56.67,;186.65,-57.44,;185.31,-56.68,;185.3,-55.14,;183.96,-54.39,;183.95,-52.85,;186.62,-54.36,;183.99,-57.45,;184,-59,;185.34,-59.77,;185.34,-61.31,;186.68,-62.07,;186.68,-63.61,;188.01,-64.38,;188.02,-65.92,;189.35,-66.68,;189.35,-63.6,;190.68,-64.36,;192.01,-63.59,;189.33,-62.05,;190.66,-61.27,;190.65,-59.73,;188,-61.3,;182.66,-59.78,;181.33,-59.01,;180,-59.79,;178.66,-59.02,;177.33,-59.79,;175.99,-59.01,;178.66,-57.47,;177.33,-56.7,;177.33,-55.16,;179.99,-56.7,;181.33,-57.47,;182.65,-56.69,;182.65,-55.15,)|
COc1ccc(CSc2nc3ccc(C)cc3c(=O)n2-c2ccccc2)cc1
COc1ccc(CSc2nc3ccc(C)cc3c(=O)n2-c2ccc(C)cc2)cc1
COc1ccc(CSc2nc3ccc(Cl)cc3c(=O)n2-c2ccccc2)cc1
COc1ccc(CSc2nc3ccc(Cl)cc3c(=O)n2-c2ccc(OC)cc2)cc1
COc1ccc(CSc2nc3ccc(Cl)cc3c(=O)n2-c2ccc(Cl)cc2)cc1
COc1ccc(CSc2nc3ccc(Cl)cc3c(=O)n2-c2ccc(C)cc2)cc1
COc1ccc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccc(OC)cc2)cc1
COc1ccc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccc(OC)cc2OC)cc1 |(142.51,-43.3,;141.18,-44.08,;139.84,-43.31,;138.51,-44.09,;137.17,-43.32,;137.17,-41.78,;135.83,-41.02,;135.83,-39.48,;134.49,-38.71,;133.16,-39.49,;131.82,-38.72,;130.49,-39.5,;129.15,-38.73,;127.82,-39.5,;126.49,-38.73,;129.16,-37.18,;127.82,-36.42,;127.82,-34.88,;130.48,-36.41,;131.82,-37.18,;133.15,-36.41,;133.14,-34.87,;134.48,-37.17,;135.81,-36.39,;137.14,-37.16,;138.47,-36.38,;138.46,-34.84,;139.79,-34.06,;141.13,-34.82,;137.12,-34.08,;135.79,-34.86,;134.45,-34.1,;134.44,-32.56,;138.49,-41.01,;139.83,-41.77,)|
COc1ccc(cc1)-n1c(SCc2cc(OC)c(OC)c(OC)c2)nc2ccc(C)cc2c1=O
COc1cc(CSc2nc3ccc(C)cc3c(=O)n2-c2ccccc2OC)cc(OC)c1OC |(122.89,-58.2,;121.55,-57.43,;121.55,-55.89,;120.21,-55.13,;120.21,-53.59,;118.88,-52.82,;118.87,-51.28,;117.53,-50.52,;116.2,-51.29,;114.86,-50.53,;113.53,-51.3,;112.2,-50.53,;112.2,-48.99,;110.86,-48.22,;113.53,-48.22,;114.86,-48.98,;116.19,-48.21,;116.18,-46.67,;117.53,-48.97,;118.85,-48.19,;120.19,-48.96,;121.52,-48.18,;121.51,-46.64,;120.16,-45.88,;118.84,-46.66,;117.5,-45.9,;117.48,-44.36,;121.53,-52.81,;122.87,-53.57,;124.2,-52.79,;124.19,-51.25,;122.88,-55.12,;124.22,-55.88,;125.55,-55.1,)|
COc1cc(CSc2nc3ccc(C)cc3c(=O)n2-c2ccc(C)cc2)cc(OC)c1OC
COc1cc(CSc2nc3ccc(Cl)cc3c(=O)n2-c2ccccc2)cc(OC)c1OC
COc1ccc(c(OC)c1)-n1c(SCc2cc(OC)c(OC)c(OC)c2)nc2ccc(Cl)cc2c1=O |(124.06,-76.73,;122.72,-75.97,;121.39,-76.75,;121.4,-78.29,;120.07,-79.07,;118.73,-78.3,;118.72,-76.77,;117.38,-76.01,;117.37,-74.47,;120.04,-75.99,;117.41,-79.08,;117.42,-80.63,;118.75,-81.39,;118.76,-82.93,;120.1,-83.7,;120.1,-85.23,;121.43,-86,;121.44,-87.54,;122.77,-88.31,;122.76,-85.22,;124.1,-85.99,;125.43,-85.21,;122.75,-83.68,;124.08,-82.9,;124.07,-81.36,;121.42,-82.92,;116.08,-81.4,;114.75,-80.63,;113.41,-81.41,;112.08,-80.64,;112.08,-79.1,;110.75,-78.33,;113.41,-78.33,;114.75,-79.09,;116.07,-78.32,;116.06,-76.78,)|
COc1cc(CSc2nc3ccc(Cl)cc3c(=O)n2-c2ccc(Cl)cc2)cc(OC)c1OC
COc1cc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccccc2OC)cc(OC)c1OC |(172.01,-66.51,;170.67,-65.74,;170.67,-64.2,;169.33,-63.44,;169.33,-61.9,;168,-61.14,;167.99,-59.6,;166.65,-58.83,;165.32,-59.61,;163.98,-58.84,;162.65,-59.62,;161.32,-58.85,;159.98,-59.61,;158.65,-58.84,;161.32,-57.3,;159.98,-56.53,;159.98,-54.99,;162.65,-56.53,;163.98,-57.29,;165.31,-56.52,;165.3,-54.98,;166.65,-57.28,;167.97,-56.51,;169.31,-57.27,;170.64,-56.5,;170.63,-54.95,;169.28,-54.19,;167.96,-54.97,;166.62,-54.22,;166.6,-52.68,;170.65,-61.12,;171.99,-61.88,;173.32,-61.1,;173.31,-59.56,;172,-63.43,;173.34,-64.19,;174.67,-63.42,)|
COc1ccc(CSc2nc3ccc(Cl)cc3c(=O)n2Cc2ccccc2)cc1
COc1cc(CSc2nc3ccc(C)cc3c(=O)n2Cc2ccccc2)cc(OC)c1OC
COc1cc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccc(Cl)cc2)cc(OC)c1OC
COc1ccc(CSc2nc3ccc(C)cc3c(=O)n2-c2ccc(OC)cc2)cc1
COc1ccc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccccc2OC)cc1 |(141.24,-46.34,;139.91,-47.11,;138.57,-46.35,;137.24,-47.13,;135.9,-46.36,;135.9,-44.82,;134.57,-44.06,;134.56,-42.52,;133.22,-41.75,;131.89,-42.53,;130.55,-41.76,;129.22,-42.54,;127.89,-41.77,;126.55,-42.54,;125.22,-41.77,;127.89,-40.22,;126.55,-39.45,;126.55,-37.91,;129.22,-39.45,;130.55,-40.22,;131.88,-39.44,;131.87,-37.9,;133.21,-40.2,;134.54,-39.43,;135.88,-40.19,;137.21,-39.42,;137.2,-37.88,;135.85,-37.11,;134.53,-37.89,;133.19,-37.14,;133.17,-35.6,;137.22,-44.05,;138.56,-44.8,)|
COc1cc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccccc2)cc(OC)c1OC
COc1cc(CSc2nc3ccc(C)cc3c(=O)n2-c2ccccc2)cc(OC)c1OC
COc1ccc(CSc2nc3ccc(C)cc3c(=O)n2Cc2ccccc2)cc1
COc1ccc(CSc2nc3ccc(Cl)cc3c(=O)n2-c2ccccc2OC)cc1 |(102.37,-34.16,;101.04,-34.94,;99.71,-34.17,;98.37,-34.95,;97.04,-34.19,;97.04,-32.65,;95.7,-31.88,;95.7,-30.34,;94.36,-29.58,;93.03,-30.35,;91.69,-29.58,;90.36,-30.36,;89.02,-29.59,;89.02,-28.05,;87.69,-27.28,;90.35,-27.28,;91.69,-28.04,;93.01,-27.27,;93.01,-25.73,;94.35,-28.03,;95.67,-27.25,;97.01,-28.02,;98.34,-27.24,;98.33,-25.7,;96.98,-24.94,;95.66,-25.72,;94.32,-24.96,;94.31,-23.42,;98.36,-31.87,;99.7,-32.63,)|
COc1ccc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccc(Cl)cc2)cc1
COc1ccc(CSc2nc3ccc(C)cc3c(=O)n2-c2ccccc2OC)cc1 |(132.03,-11.51,;130.7,-12.29,;129.36,-11.52,;128.03,-12.3,;126.7,-11.54,;126.7,-10,;125.36,-9.23,;125.35,-7.69,;124.02,-6.93,;122.68,-7.7,;121.35,-6.93,;120.01,-7.71,;118.68,-6.94,;118.68,-5.4,;117.35,-4.63,;120.01,-4.63,;121.35,-5.39,;122.67,-4.62,;122.66,-3.08,;124.01,-5.38,;125.33,-4.6,;126.67,-5.37,;128,-4.59,;127.99,-3.05,;126.64,-2.29,;125.32,-3.07,;123.98,-2.31,;123.97,-.77,;128.02,-9.22,;129.35,-9.98,)|
COc1ccc(CSc2nc3ccc(C)cc3c(=O)n2-c2ccc(Cl)cc2)cc1
COc1ccc(CSc2nc3ccc(Cl)cc3c(=O)n2-c2ccc(OC)cc2OC)cc1 |(121.11,-34.15,;119.78,-34.93,;118.44,-34.17,;117.11,-34.94,;115.78,-34.18,;115.78,-32.64,;114.44,-31.87,;114.43,-30.33,;113.1,-29.57,;111.76,-30.34,;110.43,-29.58,;109.09,-30.35,;107.76,-29.58,;107.76,-28.04,;106.43,-27.27,;109.09,-27.27,;110.43,-28.03,;111.75,-27.26,;111.74,-25.72,;113.09,-28.02,;114.41,-27.24,;115.75,-28.01,;117.08,-27.23,;117.07,-25.69,;118.4,-24.91,;119.74,-25.67,;115.72,-24.93,;114.4,-25.71,;113.06,-24.95,;113.04,-23.41,;117.1,-31.86,;118.43,-32.62,)|
COc1ccc(cc1)-n1c(SCc2cc(OC)c(OC)c(OC)c2)nc2ccc(Cl)cc2c1=O
COc1cc(CSc2nc3ccc(C)cc3c(=O)n2-c2ccc(Cl)cc2)cc(OC)c1OC
COc1ccc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccccc2)cc1
COc1cc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2Cc2ccccc2)cc(OC)c1OC
COc1ccc(CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccc(C)cc2)cc1
COc1ccc(c(OC)c1)-n1c(SCc2cc(OC)c(OC)c(OC)c2)nc2ccc(C)cc2c1=O |(139.75,-46.67,;138.41,-45.91,;137.08,-46.69,;137.09,-48.23,;135.76,-49.01,;134.42,-48.24,;134.41,-46.71,;133.07,-45.95,;133.05,-44.41,;135.73,-45.93,;133.1,-49.02,;133.11,-50.56,;134.44,-51.33,;134.45,-52.87,;135.78,-53.63,;135.78,-55.17,;137.12,-55.94,;137.12,-57.48,;138.46,-58.24,;138.45,-55.16,;139.79,-55.93,;141.12,-55.15,;138.44,-53.62,;139.77,-52.84,;139.76,-51.3,;137.1,-52.86,;131.77,-51.34,;130.44,-50.57,;129.1,-51.35,;127.77,-50.58,;127.77,-49.04,;126.44,-48.27,;129.1,-48.26,;130.43,-49.03,;131.76,-48.26,;131.75,-46.72,)|
COc1cc(CSc2nc3ccc(Cl)cc3c(=O)n2-c2ccc(C)cc2)cc(OC)c1OC
COc1cc(CSc2nc3ccc(Cl)cc3c(=O)n2Cc2ccccc2)cc(OC)c1OC
Nc1ncc(CN2CCN(CC2)c2cccc(c2)C(F)(F)F)c(N)n1
Cc1nc(N)nc(N)c1CN1CCN(CC1)c1cccc(c1)-c1ccccc1
Cn1cc(-c2c(N)nc(N)nc2C2CC2)c2ccccc12 |(20.64,-30.92,;20.01,-32.33,;18.51,-32.65,;18.34,-34.18,;17.01,-34.95,;17.01,-36.49,;18.34,-37.26,;15.68,-37.26,;14.34,-36.49,;13.01,-37.26,;14.34,-34.95,;15.68,-34.18,;15.68,-32.64,;16.45,-31.31,;14.91,-31.31,;19.75,-34.81,;20.22,-36.27,;21.74,-36.6,;22.76,-35.45,;22.29,-33.98,;20.78,-33.67,)|
Cc1nc(N)nc(N)c1C(=O)N1CCN(CC1)c1cccc(c1)-c1cccc(c1)C#N
COc1ccc(cc1C(F)(F)F)-c1c[nH]c2nc(N)nc(OC(C)C)c12
Nc1ncc(CN2CCCN(CC2)C(=O)c2cccc(c2)C(F)(F)F)c(N)n1
Nc1nc(N)c(-c2c[nH]c3ccccc23)c(n1)C1CC1 |(17.99,-35.31,;19.33,-36.08,;20.66,-35.31,;21.99,-36.08,;23.33,-35.31,;21.99,-37.62,;23.33,-38.39,;23.5,-39.92,;25,-40.23,;25.77,-38.91,;27.27,-38.58,;27.75,-37.12,;26.72,-35.98,;25.21,-36.3,;24.74,-37.76,;20.66,-38.39,;19.33,-37.62,;20.66,-39.93,;21.43,-41.26,;19.89,-41.26,)|
Cc1nc(N)nc(N)c1CN1CCN(CC1)c1cc(Cl)ccc1-c1ccccn1
Cc1nc(N)nc(N)c1C(=O)N1CCN(CC1)c1cc(Cl)ccc1-c1ccccn1
Nc1ncc(Cn2cc(-c3cccc(c3)C(F)(F)F)c3ccccc23)c(N)n1
Nc1ncc(Cn2cc(-c3ccc(F)c(F)c3)c3cnccc23)c(N)n1
Cn1c(cc2c(Cl)nc(N)nc12)-c1cccc(Cl)c1
Nc1ncc(CN2CCN(CC2)c2cc(Cl)ccc2OCc2cccc(c2)C(F)(F)F)c(N)n1
Nc1nc(Cl)c2cc([nH]c2n1)-c1cccc(Cl)c1
Nc1nc2[nH]c(cc2c(=O)[nH]1)-c1cccc(Cl)c1
Cn1c(cc2c(N)nc(N)nc12)-c1cccc(Cl)c1
Nc1ncc(Cn2ccc3c(cccc23)-c2ccc(cc2)C(F)(F)F)c(N)n1
Nc1ncc(Cn2cc(-c3cccc(Cl)c3)c3cccnc23)c(N)n1
Cc1nc(N)nc(N)c1C(=O)N1CCN(CC1)c1cccc(c1)-c1ccccc1
Cc1nc(N)nc(N)c1CN1CCN(CC1)c1cccc(c1)-c1cccc(c1)C#N
COc1cc(cc(c1)-c1ccccc1)C(O)C#Cc1c(C)nc(N)nc1N
COc1cc(CC#Cc2c(C)nc(N)nc2N)cc(c1)-c1c(C)cccc1C
COc1cc(cc(OC)c1OC)C(C#Cc1c(C)nc(N)nc1N)C(C)C
CCc1nc(N)nc(N)c1C#CC(C)c1cc(OC)c(OC)c(OC)c1
COc1ccc(OC)c(c1)C(O)C#Cc1c(C)nc(N)nc1N
COC(C#Cc1c(C)nc(N)nc1N)c1cc(OC)ccc1OC
COc1ccc(OC)c(c1)C(C)C#Cc1c(C)nc(N)nc1N
COc1cc(cc(c1)-c1cc(C)cc(C)c1)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1cc(C)cc(C)c1)[C@H](C)C#Cc1c(C)nc(N)nc1N |r|
CCc1nc(N)nc(N)c1C#C[C@H](C)c1cc(OC)c(OC)c(OC)c1 |r|
CCc1nc(N)nc(N)c1C#C[C@@H](C)c1cc(OC)c(OC)c(OC)c1 |r|
COc1cc(cc(c1)-c1ccc(C)cc1)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1ccc(C)cc1)[C@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(ccc1-c1ccccc1C)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(ccc1-c1ccccc1C)[C@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1ccc(cc1)-c1cc(OC)cc(c1)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1ccc(cc1)-c1cc(OC)cc(c1)[C@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(ccc1-c1c(C)cccc1C)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r,wD:16.18,(1.34,-3.46,;2.67,-2.68,;2.66,-1.15,;1.33,-.38,;1.32,1.16,;2.64,1.94,;3.98,1.18,;4,-.37,;5.33,-1.13,;6.65,-.35,;6.63,1.19,;7.99,-1.1,;8,-2.65,;6.67,-3.43,;5.33,-2.67,;4,-3.44,;-.01,1.92,;-.02,3.46,;-1.34,1.14,;-2.67,.36,;-4,-.41,;-4,-1.96,;-2.66,-2.73,;-5.33,-2.73,;-6.67,-1.96,;-8,-2.73,;-6.67,-.42,;-5.34,.35,;-5.34,1.89,)|
COc1cc(ccc1-c1c(C)cccc1C)[C@H](C)C#Cc1c(C)nc(N)nc1N |r,wU:16.18,(1.34,-3.46,;2.67,-2.68,;2.66,-1.15,;1.33,-.38,;1.32,1.16,;2.64,1.94,;3.98,1.18,;4,-.37,;5.33,-1.13,;6.65,-.35,;6.63,1.19,;7.99,-1.1,;8,-2.65,;6.67,-3.43,;5.33,-2.67,;4,-3.44,;-.01,1.92,;-.02,3.46,;-1.34,1.14,;-2.67,.36,;-4,-.41,;-4,-1.96,;-2.66,-2.73,;-5.33,-2.73,;-6.67,-1.96,;-8,-2.73,;-6.67,-.42,;-5.34,.35,;-5.34,1.89,)|
COc1cc(cc(c1)-c1ccc(cc1)C(C)(C)C)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1ccc(cc1)C(C)(C)C)[C@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1c(cccc1C(C)C)C(C)C)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1c(cccc1C(C)C)C(C)C)[C@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(ccc1-c1c(cccc1C(C)C)C(C)C)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r,wD:20.22,(1.34,-2.76,;2.67,-1.98,;2.66,-.44,;1.33,.32,;1.32,1.86,;2.64,2.64,;3.98,1.88,;4,.34,;5.33,-.42,;6.65,.35,;7.99,-.4,;8,-1.95,;6.67,-2.73,;5.34,-1.97,;4,-2.74,;3.6,-1.24,;3.42,-4.17,;6.63,1.89,;7.96,2.68,;5.29,2.65,;-.01,2.63,;-.02,4.17,;-1.34,1.85,;-2.67,1.07,;-4,.29,;-4,-1.26,;-2.66,-2.03,;-5.33,-2.03,;-6.67,-1.26,;-8,-2.03,;-6.67,.28,;-5.34,1.05,;-5.34,2.59,)|
COc1cc(ccc1-c1c(cccc1C(C)C)C(C)C)[C@H](C)C#Cc1c(C)nc(N)nc1N |r,wU:20.22,(1.34,-2.76,;2.67,-1.98,;2.66,-.44,;1.33,.32,;1.32,1.86,;2.64,2.64,;3.98,1.88,;4,.34,;5.33,-.42,;6.65,.35,;7.99,-.4,;8,-1.95,;6.67,-2.73,;5.34,-1.97,;4,-2.74,;3.6,-1.24,;3.42,-4.17,;6.63,1.89,;7.96,2.68,;5.29,2.65,;-.01,2.63,;-.02,4.17,;-1.34,1.85,;-2.67,1.07,;-4,.29,;-4,-1.26,;-2.66,-2.03,;-5.33,-2.03,;-6.67,-1.26,;-8,-2.03,;-6.67,.28,;-5.34,1.05,;-5.34,2.59,)|
COc1cc(cc(c1)-c1c(C)cccc1C)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1c(C)cccc1C)[C@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1ccccc1C)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1ccccc1C)[C@H](C)C#Cc1c(C)nc(N)nc1N |r|
CC[C@@H](C#Cc1c(C)nc(N)nc1N)c1cc(OC)c(OC)c(OC)c1 |r|
CC[C@H](C#Cc1c(C)nc(N)nc1N)c1cc(OC)c(OC)c(OC)c1 |r|
CO[C@H](C#Cc1c(C)nc(N)nc1N)c1cc(OC)ccc1C |r|
CO[C@@H](C#Cc1c(C)nc(N)nc1N)c1cc(OC)ccc1C |r|
COc1cc(ccc1-c1ccccc1)[C@@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(ccc1-c1ccccc1)[C@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(OC)c1OC)[C@H](C)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1ccccc1)[C@@H](O)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(c1)-c1ccccc1)[C@H](O)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(OC)c1OC)[C@@H](C)C#Cc1cnc(N)nc1N |r|
COc1cc(cc(OC)c1OC)[C@H](C)C#Cc1cnc(N)nc1N |r|
CO[C@H](C#Cc1c(C)nc(N)nc1N)c1cc(OC)c(OC)c(OC)c1 |r|
COc1cc(cc(OC)c1OC)[C@@H](O)C#Cc1cnc(N)nc1N |r|
COc1cc(cc(OC)c1OC)[C@H](O)C#Cc1cnc(N)nc1N |r|
CO[C@@H](C#Cc1cnc(N)nc1N)c1cc(OC)c(OC)c(OC)c1 |r|
CO[C@H](C#Cc1cnc(N)nc1N)c1cc(OC)c(OC)c(OC)c1 |r|
COc1cc(cc(OC)c1OC)[C@@H](O)C#Cc1c(C)nc(N)nc1N |r|
COc1cc(cc(OC)c1OC)[C@H](O)C#Cc1c(C)nc(N)nc1N |r|
COc1ccc(OC)c(c1)[C@@H](O)C#Cc1c(C)nc(N)nc1N |r|
COc1ccc(OC)c(c1)[C@H](O)C#Cc1c(C)nc(N)nc1N |r|
CO[C@H](C#Cc1c(C)nc(N)nc1N)c1cc(OC)ccc1OC |r|
CO[C@@H](C#Cc1c(C)nc(N)nc1N)c1cc(OC)ccc1OC |r|
CO[C@@H](C#Cc1c(C)nc(N)nc1N)c1cc(OC)c(OC)c(OC)c1 |r|
Cc1c(Sc2c(C)cccc2C)[nH]c2nc(N)nc(N)c12
Nc1nc(N)c2c(CSc3cccc4CCCCc34)c[nH]c2n1
Cc1c(Sc2cc(Cl)c(Cl)cc2Cl)[nH]c2nc(N)nc(N)c12
Cc1c(Sc2cccc3CCCCc23)[nH]c2nc(N)nc(N)c12
Nc1nc(N)c2c(CCCc3cc(Cl)ccc3Cl)c[nH]c2n1
COc1cc(CCCc2c[nH]c3nc(N)nc(N)c23)cc(OC)c1OC
Cc1c(Sc2cc(C)cc(C)c2)[nH]c2nc(N)nc(N)c12
CN(Cc1c[nH]c2nc(N)nc(N)c12)c1cccc2CCCCc12
Nc1nc(N)c2c(CCCc3ccccc3)c[nH]c2n1
COc1ccc(OC)c(CCCc2c[nH]c3nc(N)nc(N)c23)c1
CCn1c2ccccc2c2cc(NCc3coc4nc(N)nc(N)c34)ccc12
Nc1nc(N)c2c(CSc3ccccc3Oc3ccccc3)coc2n1
COc1cc(Sc2[nH]c3nc(N)nc(N)c3c2C)cc(OC)c1OC
CCn1c2ccccc2c2cc(ccc12)N(C)Cc1coc2nc(N)nc(N)c12
Nc1nc(N)c2c(CSc3cccc(c3)-c3ccccc3)coc2n1
Cc1[nH]c2nc(N)nc(N)c2c1Sc1ccc2CCCCc2c1
Cc1[nH]c2nc(N)nc(N)c2c1Sc1ccc(Cl)cc1Cl
Cc1[nH]c2nc(N)nc(N)c2c1Sc1ccc(Cl)cc1
Nc1nc(N)c2c(CSc3cccc(Oc4ccccc4)c3)coc2n1
Cc1[nH]c2nc(N)nc(N)c2c1Sc1cccc2CCCCc12
Nc1nc(N)c2c(CSc3ccccc3-c3ccccc3)coc2n1
Nc1nc(N)c2c(CNc3cccc4CCCCc34)c[nH]c2n1
Cc1[nH]c2nc(N)nc(N)c2c1Sc1cccc(Cl)c1
Nc1nc(N)c2c(CSc3ccc(Oc4ccccc4)cc3)coc2n1
Nc1nc(N)c2c(CSc3ccc4CCCCc4c3)c[nH]c2n1
COc1cc2oc3ccccc3c2cc1N(C)Cc1coc2nc(N)nc(N)c12
Nc1nc(N)c2c(CSc3ccc(cc3)-c3ccccc3)coc2n1
Nc1nc(N)c2c(CNc3ccc-4c(Cc5ccccc-45)c3)coc2n1
Nc1nc(N)c2c(CNc3ccc-4c(c3)C(O)c3ccccc-43)coc2n1
COc1ccc(-c2nc3nc(N)nc(N)c3[nH]2)c(c1OC)[N+]([O-])=O
Cc1[nH]c2nc(N)nc(N)c2c1Sc1ccccc1
COc1ccc(OC)c(Sc2c(C)[nH]c3nc(N)nc(N)c23)c1
Nc1nc(N)c2c(CNc3cccc4cc5ccccc5cc34)coc2n1
Nc1nc(N)c2c(CCCc3ccc(OCc4ccccc4)cc3)c[nH]c2n1
Nc1nc(N)c2c(CCCc3ccc4CCCCc4c3)c[nH]c2n1
Nc1nc(N)c2c(CCCc3cccc4CCCCc34)c[nH]c2n1
NC1=NC2(CCOCC2)N(OCCCOc2ccccc2)C(N)=N1
NC1=NC2(CCOCC2)N(OCCCOc2ccc(Br)cc2)C(N)=N1
NC1=NC2(CCOCC2)N(OCCCOc2ccc(F)cc2)C(N)=N1
NC1=NC2(CCOCC2)N(OCCCOc2ccc(Cl)cc2Cl)C(N)=N1
NC1=NC2(CCOCC2)N(OCCCOc2ccc(Cl)c(Cl)c2)C(N)=N1
NC1=NC2(CCSCC2)N(OCCCOc2ccc(Cl)cc2)C(N)=N1
NC1=NC2(CCSCC2)N(OCCCOc2ccc(Br)cc2)C(N)=N1
NC1=NC2(CCSCC2)N(OCCCOc2ccc(Cl)cc2Cl)C(N)=N1
NC1=NC2(CCOCC2)N(OCCCOc2cc(Cl)c(Cl)cc2Cl)C(N)=N1
CC(C)(C)c1ccc(OCCCON2C(N)=NC(N)=NC22CCOCC2)cc1
NC1=NC2(CCCCC2)N(OCCCOc2ccc(Cl)cc2)C(N)=N1 |c:25,t:1|
COc1ccc(OCCCON2C(N)=NC(N)=NC22CCOCC2)cc1
NC1=NC2(CCOCC2)N(OCCCOc2ccc(Cl)cc2)C(N)=N1
Cc1ccc(OCCCON2C(N)=NC(N)=NC22CCOCC2)cc1
C\C(=C\c1coc2nc(N)nc(N)c12)c1cccc2ccccc12
COc1ccc(NCc2ccc3nc(N)nc(N)c3c2)cc1OC
CCOC(=O)CCCOc1cc(ccc1OC)NCc2ccc3c(c2)c(nc(n3)N)N
COC(=O)CCCCOc1cc(NCc2ccc3nc(N)nc(N)c3c2)ccc1OC
COC(=O)c1ccc(COc2cc(NCc3ccc4nc(N)nc(N)c4c3)ccc2OC)cc1
CCCN(Cc1ccc2nc(N)nc(N)c2c1)c1ccc(OC)c(OCCCCC(=O)OC)c1
COc1ccc(NCc2ccc3nc(N)nc(N)c3c2)cc1OCCCC(O)=O
COc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:11,14|
CC(C)(C)c1cccc(OCc2cccc(c2)N2C(N)=NC(N)=NC2(C)C)c1 |c:20,23|
CC1(C)N=C(N)N=C(N)N1c1cccc(c1)[N+]([O-])=O |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(OCc2ccc(Cl)c(Cl)c2)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(COc2cccc(c2)C#N)c1 |t:3,6|
CC(=O)c1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:12,15|
CC1(C)N=C(N)N=C(N)N1c1cccc(Br)c1 |t:3,6|
CCCCOc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:14,17|
CC1(C)N=C(N)N=C(N)N1c1cccc(COc2cccc(CO)c2)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(CNc2cc(cc(c2)C(N)=O)C(N)=O)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(OCCCCOc2cccc(c2)C(F)(F)F)c1 |t:3,6|
CCCCCCCCCCCCOc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:22,25|
CC1(C)N=C(N)N=C(N)N1c1cccc(OCCCCOc2ccccc2)c1 |t:3,6|
CC(=O)Nc1cccc(OCc2cccc(c2)N2C(N)=NC(N)=NC2(C)C)c1 |c:20,23|
CC1(C)N=C(N)N=C(N)N1c1cccc(O)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(c1)C(F)(F)F |t:3,6|
CCCCCCCCCCCOc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:21,24|
CCCCCCCCCCCCCOc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:23,26|
CCc1cccc(OCc2cccc(c2)N2C(N)=NC(N)=NC2(C)C)c1 |c:18,21|
COc1cccc(OCc2cccc(c2)N2C(N)=NC(N)=NC2(C)C)c1 |c:18,21|
CC1(C)N=C(N)N=C(N)N1c1cccc(c1)S(F)(=O)=O |t:3,6|
CC(C)(C)c1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:13,16|
CC1(C)N=C(N)N=C(N)N1c1cccc(CNc2ccc(cc2)S(N)(=O)=O)c1 |t:3,6|
CCOC(=O)c1cccc(c1)N1C(=N)NC(=N)NC1(C)C
Cc1cccc(OCc2cccc(c2)N2C(N)=NC(N)=NC2(C)C)c1 |c:17,20|
CC1(C)N=C(N)N=C(N)N1c1cccc(COc2cccc(Cl)c2)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(I)c1 |t:3,6|
CCCCCCCCCOc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:19,22|
CC1(C)N=C(N)N=C(N)N1c1cccc(COc2ccccc2)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(OCc2ccccc2)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(OCCOc2ccccc2)c1 |t:3,6|
Cc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:10,13|
CC1(C)N=C(N)N=C(N)N1c1cccc(OCCOc2cccc(c2)C(F)(F)F)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(c1)C#N |t:3,6|
CCCCCCCCCCCCCCOc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:24,27|
CC1(C)N=C(N)N=C(N)N1c1cccc(Cl)c1 |t:3,6|
CC(C)c1cccc(OCc2cccc(c2)N2C(N)=NC(N)=NC2(C)C)c1 |c:19,22|
CC1(C)N=C(N)N=C(N)N1c1cccc(F)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(c1)S(N)(=O)=O |t:3,6|
CCCCCCc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:15,18|
CC1(C)N=C(N)N=C(N)N1c1cccc(COc2cccc(NC(N)=O)c2)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(COc2cccc(NC(N)=S)c2)c1 |t:3,6|
COc1ccc(c(c1)CNc2ccc3c(c2Cl)c(nc(n3)N)N)OC
CC1(N=C(N=C(N1OCCCOc2cc(c(cc2Cl)Cl)Cl)N)N)C
Nc1ncc(Cc2cc(O)cc(O)c2)c(N)n1
COc1cc(Cc2cnc(N)nc2N)cc(OCCCC(CCC(O)=O)C(O)=O)c1Br
CC(=O)Nc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:13,16|
Cc1ccccc1SCc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:19,22|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCc2ccc(CO)cc2)cc1 |t:3,6|
CCCCc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:13,16|
CC1(C)N=C(N)N=C(N)N1c1ccc(cc1)C(F)(F)F |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(cc1)C(N)=O |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(SCc2ccc(Cl)cc2)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCc2ccc(cc2)S(N)(=O)=O)cc1 |t:3,6|
CCCCCCOc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:16,19|
CC1(C)N=C(N)N=C(N)N1c1ccc(cc1)C#N |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(N)cc1 |t:3,6|
CC(=O)c1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:12,15|
CC1(C)N=C(N)N=C(N)N1c1ccc(I)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCCOc2ccc(N)cc2)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCC(=O)N2CCOCC2)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(cc1)S(N)(=O)=O |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(cc1)C#Cc1ccccc1 |t:3,6|
CCCCCCCCCc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:18,21|
CCCOc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:13,16|
CC(C)(C)c1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:13,16|
CCCCCCCCCCCOc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:21,24|
Cc1cccc(SCc2ccc(cc2)N2C(N)=NC(N)=NC2(C)C)c1 |c:17,20|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCc2ccc(cc2)C(N)=O)cc1 |t:3,6|
COc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:11,14|
CCCCCCCCCCCCOc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:22,25|
COC(=O)c1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:13,16|
CC1(C)N=C(N)N=C(N)N1c1ccc(cc1)S(C)(=O)=O |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(F)cc1 |t:3,6|
CCOC(=O)c1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:14,17|
CC1(C)N=C(N)N=C(N)N1c1ccc(Br)cc1 |t:3,6|
Cc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:10,13|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(SCc2ccccc2)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(O)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(CSc2ccccc2)cc1 |t:3,6|
CCc1nc(N)nc(N)c1C#CCc1cc(OC)ccc1-c1ccccc1
CC[C@H](Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CN(Cc1cnc2nc(N)nc(O)c2c1C)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Cc1c(CNc2ccc(cc2)C(=O)NC(CCC(O)=O)C(O)=O)cnc2nc(N)nc(O)c12
Nc1nc(O)c2cc(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
Nc1ncc(Cc2cc(OCc3ccccc3)cc(OCc3ccccc3)c2)c(N)n1
COCCOc1cc(Cc2cnc(N)nc2N)ccc1OC
CCCCOc1ccc(Cc2cnc(N)nc2N)cc1OC
CCCOc1cc(Cc2cnc(N)nc2N)cc(Br)c1OC
CCCCOc1cc(Cc2cnc(N)nc2N)cc(Br)c1OC
Cc1c(CNc2ccc(cc2)C(=O)NC(CCC(O)=O)C(O)=O)cnc2nc(N)nc(N)c12
COc1cc(Cc2cnc(N)nc2N)cc(OCC(O)=O)c1Br
CCc1ccc2nc(N)nc(N)c2c1
COc1cc(OC)cc(c1)N1CCC(CC1)c1cnc(N)nc1N
COc1ccc(cc1)N1CCC(CC1)c1cnc(N)nc1N
COc1ccc(cc1)N1C2CCC1CC(C2)c1cnc(N)nc1N |TLB:16:14:8:10.11|
Nc1ncc(Cc2ccc(cc2)C(F)(F)F)c(N)n1
c1cnccc1C(=O)NN
CCC[C@@H]1N(N=Cc2ccccc12)C(=O)\C=C\c1cc(Cc2cnc(N)nc2N)cc(OC)c1OC |r,c:5|
COc1ncc(cn1)[C@@H]1N(N=Cc2ccccc12)C(=O)\C=C\c1cc(Cc2cnc(N)nc2N)cc(OC)c1OC |r,c:11|
COc1cc(Cc2cnc(N)nc2N)c2C=C[C@H](Oc2c1OC)C1CC1 |r,c:16|
COc1cc(c2c(c1OC)O[C@H](C=C2)C3CC3)Cc4cnc(nc4N)N
COc1cc(Cc2cnc(N)nc2N)cc(OCCC(O)=O)c1Br
COc1cc(OC)cc(c1)N1C2CCC1CC(C2)c1cnc(N)nc1N |TLB:18:16:10:12.13|
Nc1nc(N)c2c3CCCc3ccc2n1
COC(=O)CCC(NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)NN)C(=O)OC(C)(C)C
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)NN)C(=O)NN
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)NN)C(O)=O
Cc1nc2ccc3ccc(CNc4ccc5C(=O)N(Cc5c4)[C@@H](CCC(O)=O)C(O)=O)cc3c2c(=O)[nH]1
Cc1nc2sc3cccc(CNc4ccc(cc4)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c3c2c(=O)[nH]1 |r|
Cc1nc2sc3cccc(CNc4ccc5C(=O)N(Cc5c4)[C@@H](CCC(O)=O)C(O)=O)c3c2c(=O)[nH]1 |r|
Nc1nc2sc3cccc(CNc4ccc(cc4)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c3c2c(=O)[nH]1 |r|
Nc1nc2sc3cccc(CNc4ccc5C(=O)N(Cc5c4)[C@@H](CCC(O)=O)C(O)=O)c3c2c(=O)[nH]1 |r|
CCOc1ccc(cc1-c1ccc2c(N)nc(N)nc2c1)-c1cccnc1
CCOc1ccc2[nH]ccc2c1-c1cc2nc(N)nc(N)c2cc1C |(1.91,-3.46,;.57,-2.69,;-.76,-3.47,;-2.09,-2.7,;-3.42,-3.47,;-4.76,-2.7,;-4.76,-1.16,;-5.91,-.13,;-5.29,1.28,;-3.76,1.12,;-3.43,-.38,;-2.09,-1.16,;-.76,-.39,;.57,-1.17,;1.9,-.39,;3.24,-1.15,;4.57,-.38,;5.91,-1.14,;4.56,1.17,;3.23,1.93,;3.22,3.47,;1.9,1.16,;.57,1.92,;-.76,1.15,;-2.1,1.92,)|
CCOc1ccc(Cl)cc1-c1cc2nc(N)nc(N)c2cc1C
CCOc1ccc(C=O)cc1-c1cc2nc(N)nc(N)c2cc1C
CC(C)c1ccccc1-c1cc2nc(N)nc(N)c2cc1C
CCOc1ccccc1-c1ccc2c(N)nc(N)nc2c1
CCc1ccccc1-c1cc2nc(N)nc(N)c2cc1C
Cc1ccccc1-c1cc2nc(N)nc(N)c2cc1C
COc1ccc(OC)c(c1)-c1cc2nc(N)nc(N)c2cc1C
COc1ccc(cc1OC)-c1cc2nc(N)nc(N)c2cc1C
Cc1cc2c(N)nc(N)nc2cc1-c1ccc(cc1)S(C)(=O)=O
Nc1nc(N)c2ccc(cc2n1)-c1ccccc1
Cc1cc2c(N)nc(N)nc2cc1-c1ccccc1
CS(=O)(=O)c1ccc(cc1)-c1ccc2c(N)nc(N)nc2c1
CCOc1ccc(C)cc1-c1cc2nc(N)nc(N)c2cc1C
CCOc1ccc(Br)cc1-c1cc2nc(N)nc(N)c2cc1C
NC1=NC2(CCCC2)N(Cc2ccc(Cl)cc2)C(N)=N1 |c:20,t:1|
COc1ccc(CN2C(N)=NC(N)=NC22CCCC2)cc1 |c:9,12|
Cc1ccc(CN2C(N)=NC(N)=NC22CCCC2)cc1 |c:8,11|
CC1(N=C(N)N=C(N)N1Cc1ccc(Cl)cc1)C1CC1 |t:2,5|
CCC1(C)N=C(N)N=C(N)N1Cc1ccc(Cl)cc1 |t:4,7|
CCC1(C)N=C(N)N=C(N)N1Cc1ccc(OC)cc1 |t:4,7|
CCC1(C)N=C(N)N=C(N)N1Cc1ccc(C)cc1 |t:4,7|
COc1cc(CN2C(N)=NC(N)=NC2(C)C)cc(OC)c1OC |c:8,11|
CC1(C)N=C(N)N=C(N)N1Cc1ccc(F)cc1 |t:3,6|
NC1=NC2(CCCC2)N(Cc2ccc(Cl)c(Cl)c2)C(N)=N1 |c:21,t:1|
Cc1ccc(CN2C(N)=NC(N)=NC22CCCCC2)cc1 |c:8,11|
COc1ccc(CN2C(N)=NC(N)=NC22CCCCC2)cc1 |c:9,12|
NC1=NC2(CCCCC2)N(Cc2ccc(F)cc2)C(N)=N1 |c:21,t:1|
NC1=NC2(CCCCC2)N(Cc2ccc(Cl)cc2)C(N)=N1 |c:21,t:1|
Clc1ccc(CN2C(=N)NC(=N)NC22CCCCC2)cc1Cl
COc1cc(CN2C(N)=NC(N)=NC22CCCCC2)cc(OC)c1OC |c:8,11|
NC1=NC2(CCCCCC2)N(Cc2ccc(Cl)c(Cl)c2)C(N)=N1 |c:23,t:1|
Cc1ccc(CN2C(N)=NC(N)=NC22CCCCCC2)cc1 |c:8,11|
CCC1(C)N=C(N)N=C(N)N1OCc1ccccc1 |t:4,7|
NC1=NC(C2CC2)N(OCc2ccccc2)C(N)=N1 |c:19,t:1|
NC1=NC2(CCC2)N(OCc2ccccc2)C(N)=N1 |c:19,t:1|
NC1=NC2(CCCCCC2)N(OCc2ccccc2)C(N)=N1 |c:22,t:1|
CC(C)CC(NS(=O)(=O)c1ccc(N)cc1)c1nc2ccccc2c(=O)n1-c1cccc(Cl)c1
CC(C)CC(NS(=O)(=O)c1ccc(N)cc1)c1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1
CC(C)CC(NS(=O)(=O)c1ccc(N)cc1)c1nc2ccccc2c(=O)n1-c1ccccc1Br |(70.91,-14.24,;70.92,-15.78,;72.25,-16.55,;69.59,-16.56,;69.59,-18.1,;68.26,-18.87,;66.92,-18.1,;66.14,-16.76,;67.69,-16.76,;65.59,-18.88,;64.26,-18.1,;62.93,-18.88,;62.93,-20.42,;61.6,-21.19,;64.28,-21.18,;65.6,-20.41,;70.93,-18.86,;72.26,-18.08,;73.59,-18.86,;74.91,-18.1,;76.24,-18.86,;76.24,-20.4,;74.91,-21.17,;73.58,-20.4,;72.26,-21.16,;72.26,-22.7,;70.93,-20.4,;69.6,-21.17,;68.26,-20.4,;66.93,-21.17,;66.93,-22.72,;68.27,-23.48,;69.6,-22.71,;70.94,-23.47,)|
CC(C)CC(NS(=O)(=O)c1ccc(N)cc1)c1nc2ccccc2c(=O)n1-c1ccc(Br)cc1
CCN(CC)CCC[C@@H](C)Nc1ccnc2c1ccc(c2)Cl
COc1ccc(cc1)-n1c(nc2ccccc2c1=O)C(CC(C)C)NS(=O)(=O)c1ccc(N)cc1
Oc1nnn(CC2CC2)c1C(=O)Nc1c(F)c(F)c(c(F)c1F)-c1ccccc1
Oc1nn(CC2CC2)nc1C(=O)Nc1c(F)c(F)c(c(F)c1F)-c1ccccc1
Cn1nc(O)c(n1)C(=O)Nc1ccc(cc1F)-c1ccccc1
Cn1nc(O)c(n1)C(=O)Nc1c(F)cc(cc1F)-c1ccccc1
Cn1nc(O)c(n1)C(=O)Nc1c(F)c(F)c(-c2ccccc2)c(F)c1F
Oc1nsnc1C(=O)Nc1c(F)c(F)c(-c2ccccc2)c(F)c1F
Oc1nsnc1C(=O)Nc1c(F)c(F)c(-c2cccc(OC(F)(F)F)c2)c(F)c1F
Fc1c(F)c(-c2ccccc2)c(F)c(F)c1NC(=O)c1no[nH]c1=O
C/C(=C(\C#N)/C(=O)Nc1ccc(cc1)C(F)(F)F)/O
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F
Cn1nnc(O)c1C(=O)Nc1c(F)c(F)c(-c2ccccc2)c(F)c1F
Cc1c(C(=O)Nc2c(F)c(F)c(-c3ccccc3)c(F)c2F)c(O)nn1C
Fc1c(F)c(-c2cccc(OC(F)(F)F)c2)c(F)c(F)c1NC(=O)c1no[nH]c1=O
Nc1nc(N)c2c(n1)[nH]c1cccc(Sc3ccc(Cl)cc3)c21
COc1ccc(OC)c(Sc2cccc3[nH]c4nc(N)nc(N)c4c23)c1
Nc1nc(N)c2c(n1)[nH]c1cccc(Sc3ccc4ccccc4c3)c21
Nc1nc(N)c2c(n1)[nH]c1cccc(Sc3cccc4ccccc34)c21
COc1ccc(Sc2cccc3[nH]c4nc(N)nc(N)c4c23)cc1
CC1(C)N=C(N)N=C(N)N1OCCOc1cccc(c1)C(=O)C=Cc1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCOc1ccc(cc1)C(=O)C=Cc1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCOc1ccc(C=CC(=O)c2ccccc2)cc1
CC1(C)N=C(N)N=C(N)N1OCCOc1cccc(C=CC(=O)c2ccccc2)c1
CC1(C)N=C(N)N=C(N)N1OCCCOc1ccc(cc1)C(=O)C=Cc1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCCOc1cccc(c1)C(=O)C=Cc1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCCCOc1ccc(cc1)C(=O)C=Cc1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCCCOc1cccc(c1)C(=O)C=Cc1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCCCOc1ccc(C=CC(=O)c2ccccc2)cc1
CC1(C)N=C(N)N=C(N)N1OCCCCOc1cccc(C=CC(=O)c2ccccc2)c1
NC1=NC2(CCCC2)N(OCCOc2cccc(c2)C(=O)C=Cc2ccccc2)C(N)=N1
NC1=NC2(CCCC2)N(OCCCOc2cccc(c2)C(=O)C=Cc2ccccc2)C(N)=N1
NC1=NC2(CCCC2)N(OCCCCOc2cccc(c2)C(=O)C=Cc2ccccc2)C(N)=N1
CC1(C)N=C(N)N=C(N)N1OCCCOc1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCCOc1ccc(C=CC(=O)c2ccccc2)cc1
CC1(C)N=C(N)N=C(N)N1OCCCOc1cccc(C=CC(=O)c2ccccc2)c1
CC1(C)N=C(N)N=C(N)N1OCCCOc1cccc(c1)C(=O)CCc1ccccc1
Nc1nc(N)c2c(OCC3CCOCC3)cccc2n1
Nc1nc(N)c2c(COc3cc(F)cc(c3)C#N)cccc2n1
Nc1nc(N)c2c(OCc3cc(F)cc(F)c3)cccc2n1
CC1(COc2cccc3nc(N)nc(N)c23)COC1
COC[C@H](C)Oc1cccc2nc(N)nc(N)c12 |r|
COC[C@@H](C)Oc1cccc2nc(N)nc(N)c12 |r|
Nc1nc(N)c2c(COc3cccc(F)c3)cccc2n1
Cc1ncccc1OCc1cccc2nc(N)nc(N)c12
Cc1nc(N)nc(N)c1NC(=O)C12CC3CC(CC(C3)C1)C2 |TLB:15:16:20:13.14.19,19:14:21:20.18.17,19:18:21:13.14.15,THB:15:14:20:21.16.17|
Cc1nc(N)nc(N)c1-c1cccc2ccccc12 |(6.16,-5.11,;4.82,-4.34,;3.47,-5.11,;2.16,-4.34,;.81,-5.11,;2.16,-2.8,;3.47,-2.03,;3.47,-.49,;4.82,-2.8,;6.13,-2,;7.16,-3.15,;8.66,-2.83,;9.14,-1.39,;8.12,-.24,;8.6,1.24,;7.61,2.36,;6.1,2.04,;5.59,.6,;6.61,-.56,)|
Nc1nc(N)c2nc(CN(CC#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
CCCN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CCCCCCCCN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc2ncc(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cc2c(=O)[nH]1
Nc1nc(N)c2cc(CCc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2CC(CCc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)CNc2n1
Nc1nc2NCC(CCc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)Cc2c(=O)[nH]1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCN)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CN)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCCN)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2c1C)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2c1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CCN(Cc1cnc2nc(N)nc(N)c2c1C)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc2NCC(CN(CC#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)=Nc2c(=O)[nH]1 |c:30|
Nc1nc2ncc(CN(CC#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)nc2c(=O)[nH]1
Nc1nc2ncc(CN(CC#C)c3ccc(cc3)C(O)=O)nc2c(=O)[nH]1
Nc1nc2NCC(CN(CC#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)Nc2c(=O)[nH]1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCC(=O)N[C@]34C[C@H]5C[C@H](C[C@H](C5)C3)C4)C(O)=O)cnc2n1 |THB:30:29:26:31.33.32,30:31:26:29.34.28|
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCC(=O)Nc3ccccc3)C(O)=O)cnc2n1
CC(C)(C)NC(=O)CCC(NC(=O)c1ccc(NCc2cnc3nc(N)nc(N)c3n2)cc1)C(O)=O
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCC(=O)NCc3c(Cl)cccc3Cl)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCC(=O)NCc3ccc(Cl)c(Cl)c3)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCC(=O)NCc3ccccc3)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCC(=O)Nc3ccc4OCOc4c3)C(O)=O)cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)Nc1ccc(O)c(O)c1)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)Nc1ccc2OCOc2c1)C(O)=O
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCC(=O)Nc3ccc(O)c(O)c3)C(O)=O)cnc2n1
Nc1nc2ccc(CN(C#C)c3ccc(cc3)C(=O)NC(CCC=O)C([O-])=O)cc2c(=O)[nH]1
Nc1nc2ccc(CN(C#C)c3ccc(cc3)C(=O)NC(CCC(=O)NC(CCC(=O)NC(CCC([O-])=O)C(O)=O)C(O)=O)C(O)=O)cc2c(=O)[nH]1
Nc1nc2ccc(CN(C#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(=O)NC(CCC([O-])=O)C(O)=O)cc2c(=O)[nH]1
Nc1nc2ccc(CN(C#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(=O)NC(CCC(=O)NC(CCC(=O)NC(CCC(=O)NC(CCC([O-])=O)C(O)=O)C(O)=O)C(O)=O)C(O)=O)cc2c(=O)[nH]1
Nc1nc2ccc(CN(C#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(=O)NC(CCC(=O)NC(CCC(=O)NC(CCC([O-])=O)C(O)=O)C(O)=O)C(O)=O)cc2c(=O)[nH]1
Nc1nc2ccc(CN(CC3CC3)c3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cc2c(=O)[nH]1
CC#CCN(Cc1ccc2nc(N)[nH]c(=O)c2c1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCNC(=O)CBr)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCCNC(=O)CBr)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCCNC(=O)CCl)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCNC(=O)CCl)C(O)=O
Nc1nc2CCC(CCNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)Nc2c(=O)[nH]1
Nc1nc2ccc(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)nc2c(=O)[nH]1
Nc1nc2CCC(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)Nc2c(=O)[nH]1
Nc1nc2ccc(CCNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)nc2c(=O)[nH]1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(C\C=C\C(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N(CCC(O)=O)CC(O)=O
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(C\C=C\C(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3cccc(c3)C(=O)NC(CCC(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CN(C=O)c3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccccc3)C(O)=O)cnc2n1
CC(=O)NCCCC(NC(=O)c1ccc(NCc2cnc3nc(N)nc(N)c3n2)cc1)C(O)=O
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccc(Cl)c(Cl)c3)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CN(C=O)c3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccc(Cl)c(Cl)c3)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccc(Cl)cc3)C(O)=O)cnc2n1
CC(=O)NCCCC(NC(=O)c1ccc(cc1)N(Cc1cnc2nc(N)nc(N)c2n1)C=O)C(O)=O
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCNC(=O)CCC(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccccc3)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CN(C=O)c3ccc(cc3)C(=O)NC(CCCNC(=O)c3ccc(Cl)cc3)C(O)=O)cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCCCCC(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCCCCCC(O)=O)C(O)=O
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCCCCCCCCC(O)=O)C(O)=O)cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCCCCCCC(O)=O)C(O)=O
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCCCCC(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCCCCCCCC(O)=O)C(O)=O)cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCCCCCCCC(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCCCCCCCCCC(O)=O)C(O)=O
CC(=O)c1ccc(cc1)N(CC#C)Cc1ccc2nc[nH]c(=O)c2c1
CN(C)S(=O)(=O)c1ccc(cc1)N(CC#C)Cc1ccc2nc(N)[nH]c(=O)c2c1
CC(=O)c1ccc(cc1)N(CC#C)Cc1ccc2nc(N)[nH]c(=O)c2c1
NC(=O)c1ccc(cc1)N(CC#C)Cc1ccc2nc(N)[nH]c(=O)c2c1
Nc1nc2ccc(CN(CC#C)c3ccc(cc3)C#N)cc2c(=O)[nH]1
COc1cc(cc(OC)c1OC)N(CC#C)Cc1ccc2nc[nH]c(=O)c2c1
Nc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)C(F)(F)F)cc2c(=O)[nH]1
Nc1nc2ccc(CN(CC#C)c3ccc(cc3)[N+]([O-])=O)cc2c(=O)[nH]1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CC(=C)C(O)=O)C(O)=O)cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CC(C#N)C(O)=O)C(O)=O
CN(Cc1cnc2ncnc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
CN(Cc1cnc2nc(C)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCC(=O)Nc3cccc(c3)C(O)=O)C(O)=O)cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)Nc1cccc(c1)C(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)Nc1cccc(c1)B(O)O)C(O)=O
CCOP(O)(=O)CCC(NC(=O)c1ccc(NCC2CNc3nc(N)[nH]c(=O)c3C2)cc1)C(O)=O
Nc1nc2NCC(CNc3ccc(cc3)C(=O)NC(CCS(O)(=O)=O)C(O)=O)Cc2c(=O)[nH]1
Nc1nc2ncc(CNc3ccc(cc3)C(=O)NC(CCP(O)(O)=O)C(O)=O)cc2c(=O)[nH]1
Nc1nc2NCC(CNc3ccc(cc3)C(=O)NC(CCP(O)(O)=O)C(O)=O)Cc2c(=O)[nH]1
Nc1nc2ncc(CNc3ccc(cc3)C(=O)NC(CCS(O)(=O)=O)C(O)=O)cc2c(=O)[nH]1
CCOP(O)(=O)CCC(NC(=O)c1ccc(NCc2cnc3nc(N)[nH]c(=O)c3c2)cc1)C(O)=O
Nc1nc2CCC(CCCc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)c2c(N)n1
c1c[nH]c2c1C(=O)NC(=N2)N
Nc1nc2CCC(CCc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)c2c(N)n1
Nc1nc2CCC(CCc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)c2c(=O)[nH]1
Nc1nc2CCC(CCCc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)c2c(=O)[nH]1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCNC(=O)c3ccccc3C(O)=O)C(O)=O)cnc2n1
Nc1nc2NCC(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)N(C=O)c2c(=O)[nH]1
Nc1nc(N)c2nc(CNc3c(Cl)cc(cc3Cl)C(=O)NC(CCCNC(=O)c3ccccc3C(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCCCNC(=O)c3ccccc3C(O)=O)C(O)=O)cnc2n1
COc1ccc(OC)c(CCNc2ccc3nc(N)nc(N)c3c2Cl)c1
COc1ccc(OC)c(CCCNc2ccc3nc(N)nc(N)c3c2Cl)c1
COc1cc(CCCNc2ccc3nc(N)nc(N)c3c2Cl)cc(OC)c1OC
COc1cc(CNc2ccc3nc(N)nc(N)c3c2Cl)cc(OC)c1OC
COc1cc(CCNc2ccc3nc(N)nc(N)c3c2Cl)cc(OC)c1OC
COc1cc(CN(C)c2ccc3nc(N)nc(N)c3c2Cl)cc(OC)c1OC
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(C(O)=O)C(F)(F)CC(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CC(F)C(O)=O)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@H](C[C@@H](F)C(O)=O)C(O)=O
COc1ccc(Sc2c(C)[nH]c3nc(N)[nH]c(=O)c23)cc1OC
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(Cl)cc1
C[N@](Cc1coc2c1c(nc(n2)N)N)c3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O
CC(Cc1coc2nc(N)nc(N)c12)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
C\C(=C/c1coc2nc(N)nc(N)c12)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
Cc1nc(N)nc2n(Cc3ccccc3)cc(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c12
Cc1nc(N)nc2[nH]cc(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c12
Cc1cn(C2O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O |r|
Nc1nc(N)c2nc(COC(=O)c3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2n1
Nc1nc(N)c2cc(COC(=O)c3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)ccc2n1
COc1ccc(NCc2c[nH]c3nc(N)[nH]c(=O)c23)c(OC)c1
Nc1nc2[nH]cc(CNc3cc(Cl)ccc3Cl)c2c(=O)[nH]1
Nc1nc2[nH]cc(CNc3ccc(Cl)cc3Cl)c2c(=O)[nH]1
Nc1nc2[nH]cc(CNc3cccc(Cl)c3)c2c(=O)[nH]1
COc1cc(OC)cc(c1)N(C)Cc1c[nH]c2nc(N)[nH]c(=O)c12
Nc1nc2[nH]cc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c2c(=O)[nH]1
COc1cc(cc(OC)c1OC)N(C)Cc1c[nH]c2nc(N)[nH]c(=O)c12
Nc1nc2[nH]cc(CNc3cc(Cl)cc(Cl)c3)c2c(=O)[nH]1
COc1ccc(OC)c(NCc2c[nH]c3nc(N)[nH]c(=O)c23)c1
COc1cc(NCc2c[nH]c3nc(N)[nH]c(=O)c23)cc(OC)c1OC
COc1ccc(OC)c(c1)N(C)Cc1c[nH]c2nc(N)[nH]c(=O)c12
Cc1cn(C2CC(O)C(OP(O)(O)=O)O2)c(=O)[nH]c1=O
COc1cc(NCc2c[nH]c3nc(N)[nH]c(=O)c23)cc(OC)c1
Nc1nc(N)c2cc3CN(CCc3nc2n1)C(=O)OCc1ccccc1
Nc1nc(N)c2cc3CN(Cc4ccc(Cl)cc4Cl)CCc3nc2n1
COc1cc(CN2CCc3nc4nc(N)nc(N)c4cc3C2)cc(OC)c1
COc1ccc(CN2CCc3nc4nc(N)nc(N)c4cc3C2)cc1
Nc1nc(N)c2cc3CN(Cc4ccc(Cl)c(Cl)c4)CCc3nc2n1
Nc1nc(N)c2cc3CN(Cc4ccc(cc4)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CCc3nc2n1
Nc1nc(N)c2cc3CN(Cc4ccccc4)CCc3nc2n1
[#8-]-[#6](=O)-c1ccccc1\[#6](=[#6]-1\[#6]=[#6](I)-[#6](=O)-[#6](I)=[#6]-1)-c1cc(I)c(-[#8-])c(I)c1 |c:18,t:12|
Oc1ccccc1\C=N\NC(=O)C(=O)N\N=C\c1ccccc1O
Oc1ccc(cc1)N=Nc1ccc(Br)cc1 |w:8.9|
Oc1ccc(cc1O)-c1csc(Nc2ccc(F)cc2F)n1
Oc1c2c(cc(Cl)cc2=C)s\c1=c1\sc2cc(Cl)cc(=C)c2c1O
[O-][N+](=O)c1ccc(NN2C(=O)C3C(C2=O)[C@@]2(Cl)C(Cl)=C(Cl)[C@]3(Cl)C2(Cl)Cl)c(c1)[N+]([O-])=O |t:19,TLB:9:11:23:19.17,20:19:23:11.12,THB:13:12:23:19.17,18:17:23:11.12|
CC(C)c1ccc(\C=C2\C(=O)Nc3ccccc23)cc1
Nc1c(cc(c2ccccc12)S([O-])(=O)=O)\N=N\c1ccc(cc1)-c1ccc(cc1)\N=N\c1cc(c2ccccc2c1N)S([O-])(=O)=O
Clc1ccc2sc(Sc3nnc(NC(=O)c4ccc(Cl)c(Cl)c4)s3)nc2c1
Nc1nc(N)c2cc(COC(=O)c3ccc(cc3)C(=O)N[C@@H](CCCC(O)=O)C(O)=O)ccc2n1
Nc1nc(N)c2cc(COC(=O)c3ccc(cc3)C(=O)N[C@H](CCC(O)=O)C(O)=O)ccc2n1
CCc1nc(N)nc2[nH]c(C)c(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c12
CCc1nc(N)nc2[nH]cc(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c12
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1cc(Cl)cc(Cl)c1
CN(Cc1ccc2NC(N)=NC(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O |c:9|
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(F)cc1
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(cc1)C(F)(F)F
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(Br)cc1
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(Br)c(c1)[N+]([O-])=O
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1cc(F)cc(F)c1
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1cc(cc(c1)C(F)(F)F)C(F)(F)F
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(Br)c(Cl)c1
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(F)c(F)c1
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(F)c(Cl)c1
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1cccc(F)c1
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1cccc(Cl)c1
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(cc1)C#N
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1cccc(Br)c1
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(Cl)c(c1)[N+]([O-])=O
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(OC(F)(F)F)cc1
[O-][N+](=O)c1cccc(\C=N\c2nc3ccccc3s2)c1
Clc1ccc(\C=N\c2nc3ccccc3s2)cc1
[O-][N+](=O)c1ccccc1\C=N\c1nc2ccccc2s1
Oc1ccc(\C=N\c2nc3ccccc3s2)cc1
Brc1ccc(\C=N\c2nc3ccccc3s2)cc1
Cc1[nH]c2nc(N)[nH]c(=O)c2c1Sc1ccc(C(=O)N[C@@H](CCC(O)=O)C(O)=O)c(F)c1 |r|
Cc1c(c2c([nH]1)N=C(NC2=O)N)Sc3ccc(c(c3)Cl)C(=O)NC(CCC(=O)O)C(=O)O
Nc1nc2[nH]cc(CCCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c2c(=O)[nH]1 |r|
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(=O)NO)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(=O)N1CCC[C@H]1C(=O)NO)C(O)=O
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)NO)C(O)=O
CC(C)c1c(Sc2ccc(Cl)c(Cl)c2)[nH]c2nc(N)nc(N)c12
CC(C)c1c(Sc2ccc3ccccc3c2)[nH]c2nc(N)nc(N)c12
CC(C)c1c(Sc2cccc3ccccc23)[nH]c2nc(N)nc(N)c12
COc1ccc(Sc2[nH]c3nc(N)nc(N)c3c2C(C)C)cc1OC
COc1ccc(OC)c(Sc2[nH]c3nc(N)nc(N)c3c2C(C)C)c1
COc1ccc(Sc2[nH]c3nc(N)nc(N)c3c2C(C)C)cc1
CC(C)c1c(Sc2ccccc2)[nH]c2nc(N)nc(N)c12
CC(C)c1c(Sc2c(C)cccc2C)[nH]c2nc(N)nc(N)c12
CC(C)c1c(Sc2c(Cl)cccc2Cl)[nH]c2nc(N)nc(N)c12
CCCc1c(Sc2ccc3ccccc3c2)[nH]c2nc(N)nc(N)c12
CCCc1c(Sc2cccc3ccccc23)[nH]c2nc(N)nc(N)c12
CCCc1c(Sc2ccc(OC)c(OC)c2)[nH]c2nc(N)nc(N)c12
CCCc1c(Sc2cc(OC)ccc2OC)[nH]c2nc(N)nc(N)c12
CCCc1c(Sc2ccc(OC)cc2)[nH]c2nc(N)nc(N)c12
CCCc1c(Sc2ccccc2)[nH]c2nc(N)nc(N)c12
CCCc1c(Sc2c(C)cccc2C)[nH]c2nc(N)nc(N)c12
CCCc1c(Sc2c(Cl)cccc2Cl)[nH]c2nc(N)nc(N)c12
CCCc1c(Sc2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[nH]c2nc(N)nc(N)c12 |r|
CC(C)c1c(Sc2ccc(CC(=O)N[C@@H](CCC(O)=O)C(O)=O)cc2)[nH]c2nc(N)nc(N)c12 |r|
CCCCN(Cc1ccc2ccccc2c1)c1ccc2nc(N)nc(N)c2c1
CCCCN(Cc1cc(OC)ccc1OC)c1ccc2nc(N)nc(N)c2c1
CCCN(Cc1ccc2ccccc2c1)c1ccc2nc(N)nc(N)c2c1
CCCN(Cc1cc(OC)ccc1OC)c1ccc2nc(N)nc(N)c2c1
CCN(Cc1cc(Cl)cc(Cl)c1Cl)c1ccc2nc(N)nc(N)c2c1
CCN(Cc1cc(OC)ccc1OC)c1ccc2nc(N)nc(N)c2c1
CCN(Cc1ccc2ccccc2c1)c1ccc2nc(N)nc(N)c2c1
CCN(Cc1cccc2ccccc12)c1ccc2nc(N)nc(N)c2c1
CCN(Cc1ccccc1)c1ccc2nc(N)nc(N)c2c1
Cc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(F)cc1
Cc1sc2nc(N)[nH]c(=O)c2c1Sc1ccncc1
Cc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc2ccccc2c1
Cc1sc2nc(N)[nH]c(=O)c2c1Sc1cc(Cl)cc(Cl)c1
Cc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(Cl)c(Cl)c1
COc1ccc(OC)c(Sc2c(C)[nH]c3nc(N)[nH]c(=O)c23)c1
Cc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(cc1)[N+]([O-])=O
Cc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(Cl)cc1
Cc1sc2nc(N)[nH]c(=O)c2c1Sc1ccccc1
Cc1sc2nc(N)[nH]c(=O)c2c1Sc1ccc(cc1)C(=O)N(CCC(O)=O)C(O)=O
CCCN(CCC)[C@H]1CCn2cccc2C1
CC1(N=C(N=C(N1c2ccc(c(c2)Cl)Cl)N)N)C
NC1=NC2(CCCCC2)N(C(N)=N1)c1cccc(c1)C(F)(F)F |c:12,t:1|
CC(C)c1ccc(cc1)N(C)c2cc3c(nc(nc3nc2)N)N
Oc1ccc(\C=N\c2ccc(cc2)-c2nnc(S)n2\N=C\c2ccc(O)cc2)cc1
[O-][N+](=O)c1cccc(\C=N\c2ccc(cc2)-c2nnc(S)n2\N=C\c2cccc(c2)[N+]([O-])=O)c1
Sc1nnc(-c2ccc(cc2)\N=C\c2ccc(Cl)cc2)n1\N=C\c1ccc(Cl)cc1
Sc1nnc(o1)-c1ccc(cc1)\N=C\c1ccc(Cl)cc1
NC1=NC2(CCCCC2)N(C(N)=N1)c1ccccc1 |c:12,t:1|
NC1=NC2(CCCCC2)N(C(N)=N1)c1ccccc1Cl |c:12,t:1|
NC1=NC2(CCCCC2)N(C(N)=N1)c1cccc(Cl)c1 |c:12,t:1|
NC1=NC2(CCCCC2)N(C(N)=N1)c1ccc(Cl)cc1 |c:12,t:1|
CC1(C)N=C(N)N=C(N)N1Cc1ccccc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1Cc1ccc(Cl)cc1 |t:3,6|
Cc1ccc(CN2C(N)=NC(N)=NC2(C)C)cc1 |c:8,11|
COc1ccc(CN2C(N)=NC(N)=NC2(C)C)cc1 |c:9,12|
CC1(C)N=C(N)N=C(N)N1Cc1ccc(Cl)c(Cl)c1 |t:3,6|
Cc1nc(N)nc(Nc2cccc(Cl)c2)n1
Cc1nc(N)nc(Nc2ccc(Cl)c(Cl)c2)n1
Cc1nc(N)nc(Nc2cccc(Br)c2)n1
Nc1nc(CCl)nc(Nc2cccc(c2)[N+]([O-])=O)n1
Nc1nc(CCl)nc(Nc2ccc(Cl)c(Cl)c2)n1
Nc1nc(CCl)nc(Nc2cccc(Br)c2)n1
O=C1NC(=O)C(N1)(c1ccccc1)c1ccccc1
Cc1ccccc1N1C(N)=NC(N)=NC11CCCCC1 |c:10,13|
Cc1cccc(c1)N1C(N)=NC(N)=NC11CCCCC1 |c:10,13|
Cc1ccc(cc1)N1C(N)=NC(N)=NC11CCCCC1 |c:10,13|
COc1ccccc1N1C(N)=NC(N)=NC11CCCCC1 |c:11,14|
COc1cccc(c1)N1C(N)=NC(N)=NC11CCCCC1 |c:11,14|
COc1ccc(cc1)N1C(N)=NC(N)=NC11CCCCC1 |c:11,14|
CC1(C)NC(Nc2ccccc2)=NC(N)=N1 |c:12,15|
CC1(C)NC(Nc2ccccc2Cl)=NC(N)=N1 |c:13,16|
CC1(C)NC(Nc2cccc(Cl)c2)=NC(N)=N1 |c:13,16|
CC1(C)NC(Nc2ccc(Cl)cc2)=NC(N)=N1 |c:13,16|
CC1(C)NC(Nc2ccccc2Br)=NC(N)=N1 |c:13,16|
CC1(C)NC(Nc2cccc(Br)c2)=NC(N)=N1 |c:13,16|
CC1(C)NC(Nc2ccc(Br)cc2)=NC(N)=N1 |c:13,16|
Cc1ccccc1NC1=NC(N)=NC(C)(C)N1 |c:12,t:9|
Cc1cccc(c1)N=C1NC(C)(C)NC(N)=N1 |w:7.7,c:16|
Cc1ccc(NC2=NC(N)=NC(C)(C)N2)cc1 |c:9,t:6|
COc1ccccc1NC1=NC(N)=NC(C)(C)N1 |c:13,t:10|
COc1cccc(NC2=NC(N)=NC(C)(C)N2)c1 |c:11,t:8|
COc1ccc(NC2=NC(N)=NC(C)(C)N2)cc1 |c:10,t:7|
Cc1c(Sc2c(Cl)cccc2Cl)oc2nc(N)nc(N)c12
Cc1c(Sc2c(C)cccc2C)oc2nc(N)nc(N)c12
Cc1c(Sc2ccc3ccccc3c2)oc2nc(N)nc(N)c12
Cc1c(Sc2cccc3ccccc23)oc2nc(N)nc(N)c12
COc1ccccc1Sc1oc2nc(N)nc(N)c2c1C
Cc1c(Sc2c(F)c(F)c(c(F)c2F)C(F)(F)F)oc2nc(N)nc(N)c12
COc1ccc(Sc2oc3nc(N)nc(N)c3c2C)cc1
COc1ccc(OC)c(Sc2oc3nc(N)nc(N)c3c2C)c1
COc1ccc(Sc2oc3nc(N)nc(N)c3c2C)cc1OC
CC(C)c1cccc(C)c1Sc1oc2nc(N)nc(N)c2c1C
Cc1c(Sc2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)oc2nc(N)nc(N)c12 |r|
COc1cccc(Sc2oc3nc(N)nc(N)c3c2C)c1
Nc1nc(N)c2c(n1)[nH]c1cccc(Sc3ccccc3)c21
Cc1ccc(Sc2cccc3[nH]c4nc(N)nc(N)c4c23)cc1
[O-][N+](=O)c1ccc2nc(SCC=C)n(Cc3ccccc3)c(=O)c2c1
Cc1ccc2nc(SCC=C)n(Cc3ccccc3)c(=O)c2c1
Nc1ccc2ncn(Cc3ccccc3)c(=O)c2c1
CSc1nc2ccc(N)cc2c(=O)n1Cc1ccccc1
[O-][N+](=O)c1ccc2nc(SCc3ccccc3)n(Cc3ccccc3)c(=O)c2c1
Cc1ccc2nc(SCc3ccccc3)n(Cc3ccccc3)c(=O)c2c1
CCSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)[N+]([O-])=O
CCSc1nc2ccc(C)cc2c(=O)n1Cc1ccccc1
CSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)[N+]([O-])=O
CSc1nc2ccc(C)cc2c(=O)n1Cc1ccccc1
[O-][N+](=O)c1ccc2[nH]c(=S)n(Cc3ccccc3)c(=O)c2c1
Cc1ccc2[nH]c(=S)n(Cc3ccccc3)c(=O)c2c1
Cc1ccc2n(C(O)\C=C\c3ccccc3)c(=S)n(Cc3ccccc3)c(=O)c2c1
CC(=O)NS(=O)(=O)c1ccc(N)cc1
C[C@H]([C@@H]1CC[C@H]([C@H](O1)O[C@@H]2[C@H](C[C@H]([C@@H]([C@H]2O)O[C@@H]3[C@@H]([C@H]([C@@](CO3)(C)O)NC)O)N)N)N)NC
Nc1ccc2nc(SC\C=C\c3ccccc3)n(Cc3ccccc3)c(=O)c2c1
Nc1ccc2nc(SCC=C)n(Cc3ccccc3)c(=O)c2c1
[O-][N+](=O)c1ccc2nc(SC\C=C\c3ccccc3)n(Cc3ccccc3)c(=O)c2c1
Cc1ccc2nc(SC\C=C\c3ccccc3)n(Cc3ccccc3)c(=O)c2c1
C=CCSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)N(C\C=C\c1ccccc1)C\C=C\c1ccccc1
C=CCSc1nc2ccc(NC\C=C\c3ccccc3)cc2c(=O)n1Cc1ccccc1
CSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)N(C\C=C\c1ccccc1)C\C=C\c1ccccc1
CSc1nc2ccc(NC\C=C\c3ccccc3)cc2c(=O)n1Cc1ccccc1
CSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)N(C)CC=C
C=CCSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)N(CC=C)CC=C
C=CCNc1ccc2nc(SCC=C)n(Cc3ccccc3)c(=O)c2c1
CSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)N(CC=C)CC=C
CSc1nc2ccc(NCC=C)cc2c(=O)n1Cc1ccccc1
O=C(Nc1ccc2nc(SC\C=C\c3ccccc3)n(Cc3ccccc3)c(=O)c2c1)\C=C\c1ccccc1
C=CCSc1nc2ccc(NC(=O)\C=C\c3ccccc3)cc2c(=O)n1Cc1ccccc1
CSc1nc2ccc(NC(=O)\C=C\c3ccccc3)cc2c(=O)n1Cc1ccccc1
C=CC(=O)Nc1ccc2nc(SC\C=C\c3ccccc3)n(Cc3ccccc3)c(=O)c2c1
C=CCSc1nc2ccc(NC(=O)C=C)cc2c(=O)n1Cc1ccccc1
CSc1nc2ccc(NC(=O)C=C)cc2c(=O)n1Cc1ccccc1
OC(\C=C\c1ccccc1)n1c2ccc(cc2c(=O)n(Cc2ccccc2)c1=S)[N+]([O-])=O
OC(O)CCSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)[N+]([O-])=O
Cc1ccc2nc(SCCC(O)O)n(Cc3ccccc3)c(=O)c2c1
CCOC(=O)CCSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)[N+]([O-])=O
[O-][N+](=O)c1ccc2n(CC=C)c(SSc3nc(=O)c4cc(ccc4n3CC=C)[N+]([O-])=O)nc(=O)c2c1
Nc1nc(N)c2nc(CNc3ccc(cc3)S(N)(=O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)S(O)(=O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NCCc3ccc(cc3)S(N)(=O)=O)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NCCc3ccc(cc3)S(O)(=O)=O)cnc2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NCCc1ccc(cc1)S(N)(=O)=O
c1cc2c(cc1OC(F)(F)F)sc(n2)N
CS(=O)(=O)c1ccc2c(c1)sc(n2)N
c1cc(sc1)C(=O)CCc2nnc(s2)N
CCCC1N(N=Cc2ccccc12)C(=O)C=C |c:5|
CC[C@@H]1N(N=Cc2ccccc12)C(=O)\C=C\c1cc(Cc2cnc(N)nc2N)cc(OC)c1OC |r,c:4|
CCCC[C@@H]1N(N=Cc2ccccc12)C(=O)\C=C\c1cc(Cc2cnc(N)nc2N)cc(OC)c1OC |r,c:6|
OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2ccccc12 |t:13|
NC1=NC2(CCCC2)N(OCCCOc2ccc(F)cc2)C(N)=N1 |c:24,t:1|
NC1=NC2(CCCC2)N(OCCCOc2ccc(Cl)cc2)C(N)=N1 |c:24,t:1|
NC1=NC2(CCCC2)N(OCCCOc2ccc(cc2)[N+]([O-])=O)C(N)=N1 |c:26,t:1|
Cc1ccc(OCCCON2C(N)=NC(N)=NC22CCCC2)cc1 |c:12,15|
CC(C)(C)c1ccc(OCCCON2C(N)=NC(N)=NC22CCCC2)cc1 |c:15,18|
COc1ccc(OCCCON2C(N)=NC(N)=NC22CCCC2)cc1 |c:13,16|
NC1=NC2(CCCC2)N(OCCCOc2ccc(cc2)C#N)C(N)=N1 |c:25,t:1|
CC(=O)c1ccc(OCCCON2C(N)=NC(N)=NC22CCCC2)cc1 |c:14,17|
NC1=NC2(CCCCC2)N(OCCCOc2ccc(F)cc2)C(N)=N1 |c:25,t:1|
NC1=NC2(CCCCC2)N(OCCCOc2ccc(cc2)[N+]([O-])=O)C(N)=N1 |c:27,t:1|
Cc1ccc(OCCCON2C(N)=NC(N)=NC22CCCCC2)cc1 |c:12,15|
CC(C)(C)c1ccc(OCCCON2C(N)=NC(N)=NC22CCCCC2)cc1 |c:15,18|
COc1ccc(OCCCON2C(N)=NC(N)=NC22CCCCC2)cc1 |c:13,16|
NC1=NC2(CCCCC2)N(OCCCOc2ccc(cc2)C#N)C(N)=N1 |c:26,t:1|
CC(=O)c1ccc(OCCCON2C(N)=NC(N)=NC22CCCCC2)cc1 |c:14,17|
NC1=NC2(CCCCC2)N(OCCCOc2ccc(cc2)S(N)(=O)=O)C(N)=N1 |c:28,t:1|
Nc1ncc(Cn2cc(CN3CCN(CC3)c3nc4n(cc(C(O)=O)c(=O)c4cc3F)C3CC3)nn2)c(N)n1
OC(=O)c1cn(C2CC2)c2nc(N3CCN(CC#C)CC3)c(F)cc2c1=O
OC(=O)c1cn(C2CC2)c2nc(NCC#C)c(F)cc2c1=O
COc1cc(Cc2cnc(N)nc2N)cc2NCCOc12
Nc1ncc(COCc2cn(nn2)-c2nc3n(cc(C(O)=O)c(=O)c3cc2F)C2CC2)c(N)n1
Nc1nc2cc3ccccc3c2c(Nc2ccc(Cl)cc2F)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2ccc(F)c(Cl)c2)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2cccc(Br)c2)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2ccc(Cl)cc2)[nH]1
CC(C)c1ccc(Nc2[nH]c(N)nc3cc4ccccc4c23)cc1
CC(=O)N(CC1CCc2nc(N)nc(N)c2N1C=O)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
Nc1nc(N)c2N3CN(CC3CCc2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)ccc2n1 |r|
CN(CC1CCc2nc(N)nc(N)c2N1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CN(CC1CCc2nc(N)nc(N)c2N1S(=O)(=O)c1ccc(C)cc1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CN(CC1CCc2nc(N)nc(N)c2N1C=O)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CN(CC1CCc2nc(N)nc(N)c2N1CC=C)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CC(=O)N(CC1CCc2nc(N)nc(N)c2N1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)N3CCC(CC3)C(O)=O)cnc2n1
CCc1ccc(NCc2cnc3nc(N)nc(N)c3n2)cc1C(=O)N1CCC(CC1)C(=O)OC
COC(=O)C1CCN(CC1)C(=O)c1ccc(cc1)N(CCO)Cc1cnc2nc(N)nc(N)c2n1
NC(=O)C1CCN(CC1)C(=O)c1ccc(NCc2cnc3nc(N)nc(N)c3n2)cc1
CN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(cc3)C(=O)N4CCC(CC4)C(=O)OC
COC(=O)C1CCN(CC1)C(=O)c2ccc(cc2)NCc3cnc4c(n3)c(nc(n4)N)N
Nc1nc(N)c2c(Cl)c(NCc3cccc(Br)c3)ccc2n1
Nc1nc(N)c2c(Cl)c(NC(=O)Cc3ccc4ccccc4c3)ccc2n1
Nc1nc(N)c2c(CCc3ccc4ccccc4c3)cccc2n1
Nc1nc(N)c2c(cccc2n1)S(=O)(=O)c1ccc2ccccc2c1
Nc1nc(N)c2cc(Cl)ccc2n1
c1cc2c(c(c1N)Cl)c(nc(n2)N)N
c1cc2c(cc1N)c(nc(n2)N)N
Nc1nc(N)c2cc(C=O)ccc2n1
NCc1ccc2nc(N)nc(N)c2c1
Nc1nc(N)c2cc(Br)ccc2n1
Nc1nc(N)c2cc(NC(=O)Cc3ccc4ccccc4c3)ccc2n1
Nc1nc(N)c2c(Sc3ccc4ccccc4c3)cccc2n1
Nc1nc(N)c2cc(NC(=O)Cc3ccc(Cl)cc3)ccc2n1
[O-][N+](=O)c1ccc(\C=C\C=C\c2ccccc2)cc1
Nc1nc(N)c2c(\C=C/c3ccc4ccccc4c3)cccc2n1
Nc1nc(N)c2cc(ccc2n1)C#N
Nc1nc(N)c2c(Cl)cccc2n1
Nc1nc(N)c2c(Cl)c(Cl)ccc2n1
Cc1c(NC(=O)Cc2ccc(Cl)c(Cl)c2)ccc2nc(N)nc(N)c12
Nc1nc(N)c2c(cccc2n1)S(=O)c1ccc(Cl)c(Cl)c1
c1ccc2c(c1)c(nc(n2)N)N
Nc1nc(N)c2cc(NCc3ccc(Cl)c(Cl)c3)ccc2n1
Nc1nc(N)c2cc(Sc3ccc(Cl)c(Cl)c3)ccc2n1
Nc1nc(N)c2cc(Sc3cccc(c3)C(F)(F)F)ccc2n1
Cc1cccc2nc(N)nc(N)c12
Nc1nc(N)c2cc(CNC(=O)Cc3ccc(Cl)c(Cl)c3)ccc2n1
Nc1nc(N)c2cc(ccc2n1)S(=O)c1ccc2ccccc2c1
Nc1nc(N)c2c(CSc3ccc4ccccc4c3)cccc2n1
Nc1nc(N)c2c(\C=C\c3ccc4ccccc4c3)cccc2n1
Cc1c(NC(=O)Cc2ccc(Cl)cc2)ccc2nc(N)nc(N)c12
Nc1nc(N)c2c(Cl)c(NC(=O)Cc3ccc(Br)cc3)ccc2n1
Cc1ccc2nc(N)nc(N)c2c1
Nc1nc(N)c2c(cccc2n1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Cc1c(NC(=O)Cc2cccc(Br)c2)ccc2nc(N)nc(N)c12
Nc1nc(N)c2c(CSc3ccc(Cl)cc3)cccc2n1
Cc1c(NC(=O)Cc2ccc3ccccc3c2)ccc2nc(N)nc(N)c12
Nc1nc(N)c2c(Cl)c(Br)ccc2n1
Nc1nc(N)c2c(Cl)c(NC(=O)Cc3ccc(Cl)c(Cl)c3)ccc2n1
Nc1nc(N)c2c(Sc3ccc(Cl)c(Cl)c3)cccc2n1
CC1(C)N=C(N)N=C(N)N1c1ccc(SCc2ccccc2)c(Cl)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(CCCCc2ccc(cc2Cl)S(F)(=O)=O)c(Cl)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)c(c1)S(N)(=O)=O |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(CSc2ccccc2)c(Cl)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)c(CSc2ccccc2)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(cc1)C#C[Si](C)(C)C |t:3,6|
CCCCCCCCCCCCc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:21,24|
CCCCCCOc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:16,19|
CN(C)C(=O)c1ccc(COc2ccc(cc2Cl)N2C(N)=NC(N)=NC2(C)C)cc1 |c:21,24|
CCCCCCCCCOc1ccc(cc1Cl)N1C(N)=NC(N)=NC1(C)C |c:20,23|
CC1(C)N=C(N)N=C(N)N1c1cccc(CSc2ccccc2)c1 |t:3,6|
Cc1cccc(SCc2cccc(c2)N2C(N)=NC(N)=NC2(C)C)c1 |c:17,20|
CC1(C)N=C(N)N=C(N)N1c1cccc(OCC23CC4CC(CC(C4)C2)C3)c1 |t:3,6,TLB:24:23:26:19.18.20,24:19:26:23.25.22,20:21:25:19.18.24,THB:20:19:25:21.26.22,22:21:18:23.25.24,22:23:18:21.26.20|
CC1(C)N=C(N)N=C(N)N1c1cccc(COC2CCCCC2)c1 |t:3,6|
CCCOc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:13,16|
CCCCCc1ccc(OCc2cccc(c2)N2C(N)=NC(N)=NC2(C)C)cc1 |c:20,23|
CCOc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:12,15|
CC1(C)N=C(N)N=C(N)N1c1cccc(C[Se]c2ccccc2)c1 |t:3,6|
Cc1cccc(OCCOc2cccc(c2)N2C(N)=NC(N)=NC2(C)C)c1 |c:19,22|
CCc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:11,14|
CC1(C)N=C(N)N=C(N)N1c1ccc(cc1)C#C |t:3,6|
CCCCCCCCCc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:18,21|
CC1(C)N=C(N)N=C(N)N1c1cccc(COc2cccc(c2)-c2ccccc2)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(SCc2ccc(Cl)cc2)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(OCc2ccc(cc2)C(N)=O)c1 |t:3,6|
CCc1ccc(cc1N)N1C(N)=NC(N)=NC1(C)C |c:12,15|
CC1(C)N=C(N)N=C(N)N1c1ccc2CCCCc2c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(SCc2ccccc2)c1 |t:3,6|
CCCCCOc1cccc(c1)N1C(N)=NC(N)=NC1(C)C |c:15,18|
CC1(C)N=C(N)N=C(N)N1c1cccc(c1)C(O)c1ccccc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(COc2cccc3ccccc23)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(COc2ccc3ccccc3c2)c1 |t:3,6|
COc1ccc(cc1OC)N1C(N)=NC(N)=NC1(C)C |c:13,16|
CC1(C)N=C(N)N=C(N)N1c1cc(Cl)cc(Cl)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(C[N+](C)(C)C)c1 |t:3,6|
CC1=CC(C)(C)Nc2c1cc(Cc1cnc(N)nc1N)c1cccnc21 |t:1|
COc1cc(Cc2cnc(N)nc2N)cc2C(C)=CC(C)(C)Nc12 |c:18|
CSc1cc(Cc2cnc(N)nc2N)cc2C(C)=CC(C)(C)Nc12 |c:18|
COc1cc(Cc2cnc(N)nc2N)cc2C(C)=C(F)C(C)(CF)Nc12 |t:18|
CC1(C)N=C(N)N=C(N)N1c1cccc(CNc2ccc(Cl)cc2)c1 |t:3,6|
CN(C)C(=O)c1cccc(COc2ccc(cc2Cl)N2C(N)=NC(N)=NC2(C)C)c1 |c:22,25|
CSc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:11,14|
CC1(C)N=C(N)N=C(N)N1c1cccc(COc2cc(Cl)c(Cl)cc2Cl)c1 |t:3,6|
CCCCCCc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:15,18|
CC1(C)N=C(N)N=C(N)N1c1ccc(S)cc1 |t:3,6|
CCCCOc1ccc(cc1)N1C(=N)NC(=N)NC1(C)C
CCCCCCCCCCc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:19,22|
CCCCCCCc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:16,19|
CCCCCOc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:15,18|
CCCCCCCCc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:17,20|
NC1=NC2(CCCCC2)N(C(N)=N1)c1ccc(OCc2cn(CCCOc3ccc4ccc(=O)oc4c3)nn2)cc1
NC1=NC2(CCCCC2)N(C(N)=N1)c1ccc(OCc2cn(CCCCOc3ccc4ccc(=O)oc4c3)nn2)cc1
COc1ccc(cc1)-c1nc2c(N)nc(N)nc2nc1C(C)C
Cc1c(Cc2ccccc2Br)cnc2nc(N)nc(N)c12
COC(=O)CC[C@H](NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(=O)OC |r|
CCOC(=O)CC[C@H](NC(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1)C(=O)OCC |r|
Nc1nc(N)nc(n1)-c1ccc(OCc2ccc(Cl)cc2)cc1
Nc1nc(N)nc(n1)-c1ccc(OCc2cccc(Cl)c2)cc1
NC1=NC2(CCCCC2)N(Cc2cn(CCCCCOc3ccc4oc(=O)ccc4c3)nn2)C(N)=N1
NC1=NC2(CCCCC2)N(C(N)=N1)c1ccc(OCc2cn(CCCc3ccccc3)nn2)cc1
CCCc1nc(N)nc(N)c1Cc1cc(OC)c(O)c(OC)c1
COc1cc(Cc2c(N)nc(N)nc2N(C)C)cc(OC)c1OC
Cc1onc(c1C(=O)Nc1cc2C(=O)OC(=O)c3cccc(c1)c23)-c1c(F)cccc1Cl |(28.77,-31.74,;30.22,-31.29,;31.46,-32.22,;32.73,-31.33,;32.27,-29.85,;30.72,-29.84,;29.44,-29.02,;28.07,-29.69,;29.49,-27.47,;28.15,-26.71,;28.15,-25.18,;26.83,-24.41,;26.83,-22.86,;28.18,-22.09,;25.5,-22.08,;24.17,-22.86,;22.82,-22.1,;24.17,-24.41,;22.84,-25.17,;22.85,-26.71,;24.18,-27.47,;25.49,-26.7,;26.82,-27.48,;25.5,-25.17,;33.04,-28.52,;32.27,-27.17,;30.74,-27.17,;33.05,-25.84,;34.6,-25.84,;35.36,-27.2,;34.58,-28.53,;35.34,-29.87,)|
Clc1c(sc2ccccc12)C(=O)Nc1cc2C(=O)OC(=O)c3cccc(c1)c23
[O-][N+](=O)c1cccc(c1)C(=O)Nc1cc2C(=O)OC(=O)c3cccc(c1)c23
CCc1nc(N)nc(N)c1C#CC(C)c1cc(OC)cc(c1)-c1ccc2OCCOc2c1
CCc1nc(N)nc(N)c1C#CCc1cc(OC)cc(c1)-c1ccc2OCCOc2c1
CCc1c(c(nc(n1)N)N)C#C[C@@H](C)c2cc(cc(c2)OC)c3cccc4c3ccnc4
CCc1c(c(nc(n1)N)N)C#CCc2cc(cc(c2)OC)c3cccc4c3ccnc4
OC(=O)c1cccnc1Sc1nc2ccc(Cl)cc2c(=O)n1Cc1ccccc1
OC(=O)c1cccnc1Sc1nc2ccc(Cl)cc2c(=O)n1-c1ccccc1
Cc1ccc2nc(Sc3ncccc3C(O)=O)n(Cc3ccccc3)c(=O)c2c1
Cc1ccc2nc(Sc3ncccc3C(O)=O)n(-c3ccccc3)c(=O)c2c1
COc1cc2nc(Sc3cnc(N)s3)n(Cc3ccccc3)c(=O)c2cc1OC
Nc1ncc(Sc2nc3ccc(Cl)cc3c(=O)n2Cc2ccccc2)s1
Nc1ncc(Sc2nc3ccc(Cl)cc3c(=O)n2-c2ccccc2)s1
Cc1ccc2nc(Sc3cnc(N)s3)n(Cc3ccccc3)c(=O)c2c1
CCOC(=O)c1nc(N)sc1Sc1nc2cc(OC)c(OC)cc2c(=O)n1Cc1ccccc1
CCOC(=O)c1nc(N)sc1Sc1nc2ccc(Cl)cc2c(=O)n1Cc1ccccc1
CCOC(=O)c1nc(N)sc1Sc1nc2ccc(Cl)cc2c(=O)n1-c1ccccc1
CCOC(=O)c1nc(N)sc1Sc1nc2ccc(C)cc2c(=O)n1Cc1ccccc1
CCOC(=O)c1nc(N)sc1Sc1nc2ccc(C)cc2c(=O)n1-c1ccccc1
COc1cc2nc(Sc3ncccc3C(O)=O)n(Cc3ccccc3)c(=O)c2cc1OC
COc1cc2nc(Sc3ncccc3C(O)=O)n(-c3ccccc3)c(=O)c2cc1OC
COc1cc2nc(Sc3cc(ccc3C(O)=O)[N+]([O-])=O)n(Cc3ccccc3)c(=O)c2cc1OC
COc1cc2nc(Sc3cc(ccc3C(O)=O)[N+]([O-])=O)n(-c3ccccc3)c(=O)c2cc1OC
OC(=O)c1ccc(cc1Sc1nc2ccc(Cl)cc2c(=O)n1Cc1ccccc1)[N+]([O-])=O
OC(=O)c1ccc(cc1Sc1nc2ccc(Cl)cc2c(=O)n1-c1ccccc1)[N+]([O-])=O
Cc1ccc2nc(Sc3cc(ccc3C(O)=O)[N+]([O-])=O)n(Cc3ccccc3)c(=O)c2c1
Cc1ccc2nc(Sc3cc(ccc3C(O)=O)[N+]([O-])=O)n(-c3ccccc3)c(=O)c2c1
CN(c1cc(c(c(c1)F)F)F)c2cc3c(nc(nc3nc2)N)N
CN(c1cnc2nc(N)nc(N)c2c1)c1cc(F)ccc1F
CN(c1cccc2c1cccc2)c3cc4c(nc(nc4nc3)N)N
CN(c1ccc(cc1)[N+]([O-])=O)c1cnc2nc(N)nc(N)c2c1
CN(c1ccc(C)cc1)c1cnc2nc(N)nc(N)c2c1
COc1cc(cc(OC)c1OC)N(C)c1cnc2nc(N)nc(N)c2c1
COc1ccc(OC)c(c1)N(C)c1cnc2nc(N)nc(N)c2c1
COc1ccccc1N(C)c1cnc2nc(N)nc(N)c2c1
COc1ccc(cc1)N(C)c1cnc2nc(N)nc(N)c2c1
CN(c1ccccc1)c2cc3c(nc(nc3nc2)N)N
Nc1nc(N)c2cc(Nc3cc(F)c(F)c(F)c3)cnc2n1
Nc1nc(N)c2cc(Nc3cc(F)ccc3F)cnc2n1
Nc1nc(N)c2cc(Nc3cccc4ccccc34)cnc2n1
Nc1nc(N)c2cc(Nc3ccc(cc3)[N+]([O-])=O)cnc2n1
Nc1nc(N)c2cc(Nc3ccc4ccccc4c3)cnc2n1
CC(C)c1ccc(Nc2cnc3nc(N)nc(N)c3c2)cc1
Cc1ccc(Nc2cnc3nc(N)nc(N)c3c2)cc1
COc1cc(Nc2cnc3nc(N)nc(N)c3c2)cc(OC)c1OC
COc1ccc(OC)c(Nc2cnc3nc(N)nc(N)c3c2)c1
COc1ccccc1Nc1cnc2nc(N)nc(N)c2c1
COc1ccc(Nc2cnc3nc(N)nc(N)c3c2)cc1
Nc1nc(N)c2cc(Nc3ccccc3)cnc2n1
Nc1nc(N)c2cc(CSC(=S)N3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)ccc2n1
Nc1nc(N)c2cc(CSC(=S)N3CCN(CC3)c3ccc(F)cc3)ccc2n1
COc1ccc(cc1)N1CCN(CC1)C(=S)SCc1ccc2nc(N)nc(N)c2c1
Clc1ccc(cc1)-n1c(n[nH]c1=S)-c1csc(NC(=S)Nc2ccccc2)n1
S=C(Nc1nc(cs1)-c1n[nH]c(=S)n1-c1ccc(Oc2ccccc2)cc1)Nc1ccccc1
CC(=O)N(C(C)=O)c1nc(cs1)-c1n[nH]c(=S)n1-c1ccccc1
COc1ccc(cc1)-n1c(n[nH]c1=S)-c1csc(NC(=S)Nc2ccccc2)n1
Cc1ccc(cc1)-n1c(n[nH]c1=S)-c1csc(N)n1
COc1ccccc1-n1c(n[nH]c1=S)-c1csc(N)n1 |(26.2,-4.75,;27.54,-5.52,;27.54,-7.06,;26.21,-7.83,;26.21,-9.37,;27.55,-10.14,;28.88,-9.37,;28.88,-7.82,;30.21,-7.05,;31.67,-7.55,;32.58,-6.31,;31.69,-5.05,;30.22,-5.52,;28.98,-4.6,;32.12,-9.01,;31.19,-10.25,;32.09,-11.5,;33.56,-11.04,;34.79,-11.96,;33.57,-9.5,)|
COc1ccc(cc1)-n1c(n[nH]c1=S)-c1csc(N)n1
Nc1nc(cs1)-c1n[nH]c(=S)n1-c1ccc(Cl)cc1
CC(=O)N(C(C)=O)c1nc(cs1)-c1n[nH]c(=S)n1-c1ccc(Oc2ccccc2)cc1
Cc1ccc(cc1)-n1c(n[nH]c1=S)-c1csc(NC(=S)Nc2ccccc2)n1
CC(=O)N(C(C)=O)c1nc(cs1)-c1n[nH]c(=S)n1-c1ccc(Cl)cc1
COc1ccc(c(OC)c1)-n1c(n[nH]c1=S)-c1csc(n1)N(C(C)=O)C(C)=O |(3.25,-7.69,;4.59,-8.46,;5.92,-7.69,;7.26,-8.46,;8.59,-7.69,;8.59,-6.14,;7.25,-5.37,;7.25,-3.83,;5.91,-3.07,;5.92,-6.14,;9.92,-5.37,;11.38,-5.86,;12.3,-4.62,;11.4,-3.37,;9.93,-3.83,;8.69,-2.92,;11.83,-7.33,;10.91,-8.56,;11.8,-9.82,;13.27,-9.36,;13.28,-7.81,;14.51,-10.27,;14.33,-11.8,;15.57,-12.72,;12.92,-12.42,;15.92,-9.66,;17.16,-10.57,;16.09,-8.13,)|
COc1ccc(cc1)-n1c(n[nH]c1=S)-c1csc(n1)N(C(C)=O)C(C)=O
COc1ccc(c(OC)c1)-n1c(n[nH]c1=S)-c1csc(NC(=S)Nc2ccccc2)n1 |(37.8,-11.38,;39.13,-12.15,;40.47,-11.38,;41.8,-12.15,;43.14,-11.38,;43.13,-9.83,;41.8,-9.07,;41.79,-7.53,;40.46,-6.76,;40.47,-9.84,;44.46,-9.06,;45.92,-9.55,;46.84,-8.31,;45.94,-7.06,;44.47,-7.53,;43.23,-6.61,;46.37,-11.02,;45.45,-12.25,;46.34,-13.51,;47.81,-13.05,;49.14,-13.82,;50.48,-13.05,;50.48,-11.52,;51.81,-13.83,;53.14,-13.06,;54.47,-13.84,;55.81,-13.08,;55.81,-11.54,;54.47,-10.76,;53.14,-11.53,;47.82,-11.51,)|
Clc1ccc(C=C2CCCC3C2=Nc2cc(Cl)c(Cl)cc2N=C3c2ccc(Cl)cc2)cc1 |w:5.4,c:23,t:12|
Clc1cc2N=C3C(CCCC3=Cc3ccc(Br)cc3)C(=Nc2cc1Cl)c1ccc(Br)cc1 |w:11.12,c:4,21|
COc1cc(C=C2CCCC3C2=Nc2cc(C)c(C)cc2N=C3c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC |w:5.4,c:23,t:12|
COc1ccc(C=C2CCCC3C2=Nc2cc(C)c(C)cc2N=C3c2ccc(OC)c(OC)c2)cc1OC |w:6.5,c:24,t:13|
COc1ccc(C=C2CCCC3C2=Nc2cc(C)c(C)cc2N=C3c2ccc(OC)cc2)cc1 |w:6.5,c:24,t:13|
Cc1cc2N=C3C(CCCC3=Cc3ccc(Cl)cc3)C(=Nc2cc1C)c1ccc(Cl)cc1 |w:11.12,c:4,21|
Cc1cc2N=C3C(CCCC3=Cc3ccc(Br)cc3)C(=Nc2cc1C)c1ccc(Br)cc1 |w:11.12,c:4,21|
COc1cc(C=C2CCCC3C2=Nc2ccccc2N=C3c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC |w:5.4,c:21,t:12|
COc1ccc(C=C2CCCC3C2=Nc2ccccc2N=C3c2ccc(OC)c(OC)c2)cc1OC |w:6.5,c:22,t:13|
COc1ccc(C=C2CCCC3C2=Nc2ccccc2N=C3c2ccc(OC)cc2)cc1 |w:6.5,c:22,t:13|
Clc1ccc(C=C2CCCC3C2=Nc2ccccc2N=C3c2ccc(Cl)cc2)cc1 |w:5.4,c:21,t:12|
Brc1ccc(C=C2CCCC3C2=Nc2ccccc2N=C3c2ccc(Br)cc2)cc1 |w:5.4,c:21,t:12|
COc1ccc(\C=C2/CCCc3c2nc(N)nc3-c2ccc(OC)cc2)cc1
Nc1nc2\C(CCCc2c(n1)-c1ccc(Cl)cc1)=C\c1ccc(Cl)cc1
Nc1nc2\C(CCCc2c(n1)-c1ccc(Br)cc1)=C\c1ccc(Br)cc1
CCOC(=O)Cc1ccc(cc1)N(CC#C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
COc1cc(cc(OC)c1OC)N(CC#C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
COc1ccc(cc1OC)N(CC#C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
Fc1ccc(cc1F)N(CC#C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
FC(F)(F)Oc1ccc(cc1)N(CC#C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
COc1ccc(cc1)N(CC#C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
Fc1ccc(cc1)N(CC#C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
FC(F)(F)c1ccc2nc(c(CN(CC#C)c3ccc(Cl)cc3)nc2c1)-c1ccccc1
FC(F)(F)c1ccc2nc(c(CN(CC#C)c3ccccc3Cl)nc2c1)-c1ccccc1
Cc1ccc(cc1)N(CC#C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
CCOC(=O)CC[C@H](NC(=O)c1ccc(cc1)N(CC)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)C(=O)OCC |r|
CCOC(=O)Cc1ccc(cc1)N(CC)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
CCN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1cc(OC)c(OC)c(OC)c1
CCN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(OC)c(OC)c1
CCN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(F)c(F)c1
CCN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(OC(F)(F)F)cc1
CCN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(OC)cc1
CCN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(F)cc1
CCN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(Cl)cc1
CCN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(C)cc1
CN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(C)cc1
COc1cc(cc(OC)c1OC)N(C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
COc1ccc(cc1OC)N(C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
CN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(F)c(F)c1
CN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(OC(F)(F)F)cc1
COc1ccc(cc1)N(C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F
CN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(F)cc1
CN(Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)c1ccc(Cl)cc1
CCOC(=O)CC[C@H](NC(=O)c1ccc(cc1)N(C)Cc1nc2cc(ccc2nc1-c1ccccc1)C(F)(F)F)C(=O)OCC |r|
COc1cc2nc(-c3ccccn3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1OC
COc1cc2nc(-c3ccco3)n(-c3cc4nc(N)nc(N)c4cc3Cl)c2cc1OC |(42.33,-27.62,;43.83,-27.3,;44.31,-25.84,;43.29,-24.69,;43.77,-23.23,;43,-21.91,;44.03,-20.76,;43.72,-19.25,;44.76,-18.1,;43.99,-16.76,;42.48,-17.08,;42.31,-18.62,;45.44,-21.39,;46.77,-20.63,;48.11,-21.4,;49.44,-20.62,;50.78,-21.39,;52.11,-20.61,;53.45,-21.38,;52.1,-19.06,;50.76,-18.3,;50.76,-16.76,;49.44,-19.08,;48.1,-18.31,;46.77,-19.08,;45.99,-17.74,;45.28,-22.92,;46.3,-24.06,;45.82,-25.52,;46.85,-26.67,;46.38,-28.13,)|
COc1cc2nc(-c3cccs3)n(-c3cc4nc(N)nc(N)c4cc3Cl)c2cc1OC |(28.58,-28.03,;30.09,-27.71,;30.57,-26.25,;29.54,-25.1,;30.02,-23.64,;29.25,-22.31,;30.29,-21.17,;29.97,-19.66,;31.02,-18.51,;30.25,-17.17,;28.73,-17.48,;28.57,-19.02,;31.69,-21.8,;33.03,-21.03,;34.36,-21.81,;35.69,-21.03,;37.03,-21.79,;38.36,-21.02,;39.7,-21.78,;38.35,-19.47,;37.02,-18.71,;37.01,-17.17,;35.69,-19.48,;34.36,-18.72,;33.03,-19.49,;32.25,-18.14,;31.53,-23.33,;32.55,-24.47,;32.08,-25.93,;33.11,-27.07,;32.63,-28.54,)|
COc1cc2nc(-c3nccs3)n(-c3cc4nc(N)nc(N)c4cc3Cl)c2cc1OC |(14.61,-27.8,;16.12,-27.49,;16.6,-26.02,;15.58,-24.88,;16.06,-23.42,;15.29,-22.09,;16.32,-20.95,;16,-19.43,;17.05,-18.29,;16.28,-16.94,;14.77,-17.26,;14.6,-18.8,;17.73,-21.57,;19.06,-20.81,;20.39,-21.58,;21.73,-20.8,;23.06,-21.57,;24.4,-20.8,;25.73,-21.56,;24.39,-19.25,;23.05,-18.49,;23.04,-16.95,;21.73,-19.26,;20.39,-18.5,;19.06,-19.27,;18.28,-17.92,;17.56,-23.11,;18.58,-24.25,;18.11,-25.7,;19.14,-26.85,;18.66,-28.31,)|
COc1cc2nc(-c3nccs3)n(-c3cc4nc(N)nc(N)c4cc3C)c2cc1OC |(1.21,-27.45,;2.72,-27.14,;3.2,-25.67,;2.17,-24.52,;2.65,-23.07,;1.89,-21.74,;2.92,-20.6,;2.6,-19.08,;3.65,-17.94,;2.88,-16.59,;1.36,-16.91,;1.2,-18.45,;4.32,-21.22,;5.66,-20.46,;6.99,-21.23,;8.33,-20.45,;9.66,-21.22,;11,-20.44,;12.33,-21.21,;10.99,-18.9,;9.65,-18.14,;9.64,-16.6,;8.32,-18.91,;6.99,-18.14,;5.66,-18.92,;4.88,-17.57,;4.16,-22.75,;5.18,-23.89,;4.71,-25.35,;5.74,-26.5,;5.26,-27.96,)|
COc1cc2nc(-c3nccs3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1OC
Cc1cc2nc(-c3cccs3)n(-c3cc4nc(N)nc(N)c4cc3Cl)c2cc1C |(30.8,-13.77,;31.28,-12.3,;30.26,-11.15,;30.74,-9.7,;29.97,-8.37,;31,-7.23,;30.69,-5.71,;31.73,-4.57,;30.96,-3.22,;29.45,-3.54,;29.28,-5.08,;32.41,-7.85,;33.74,-7.09,;35.08,-7.86,;36.41,-7.08,;37.74,-7.85,;39.08,-7.07,;40.42,-7.84,;39.07,-5.53,;37.73,-4.77,;37.73,-3.23,;36.41,-5.54,;35.07,-4.77,;33.74,-5.55,;32.96,-4.2,;32.25,-9.38,;33.27,-10.52,;32.79,-11.98,;33.82,-13.13,)|
Cc1cc2nc(C3CCCO3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2nc(C3CCOC3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
COc1ccc(cc1)-c1nc2cc(C)c(C)cc2n1-c1ccc2c(N)nc(N)nc2c1
Cc1cc2nc(-c3ccncc3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2nc(-c3cccnc3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2nc(-c3cccn3C)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2nc(-c3cncn3C)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2nc(-c3ccoc3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2nc(-c3cscn3)n(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1cc2ncn(-c3ccc4c(N)nc(N)nc4c3)c2cc1C
Cc1ccc(cc1)C(=O)N1CCC2(CC1)N=C(N)N=C(N)N2c1cccc(Cl)c1 |t:17,20|
NC1=NC2(CCN(CC2)C(=O)Nc2ccc(F)cc2)N(C(N)=N1)c1cccc(Cl)c1 |c:23,t:1|
CCS(=O)(=O)N1CCC2(CC1)N=C(N)N=C(N)N2CCOC |t:12,15|
CC(NS(=O)(=O)c1ccc(NC(C)=O)cc1)c1nc2ccccc2c(=O)n1\N=C\c1cccc(c1)[N+]([O-])=O
CC(NS(=O)(=O)c1ccc(NC(C)=O)cc1)c1nc2ccccc2c(=O)n1\N=C\c1ccc(C)cc1
CC(NS(=O)(=O)c1ccc(NC(C)=O)cc1)c1nc2ccccc2c(=O)n1\N=C\c1cccc(F)c1
CC(NS(=O)(=O)c1ccc(NC(C)=O)cc1)c1nc2ccccc2c(=O)n1\N=C\c1ccc(F)cc1
CC(NS(=O)(=O)c1ccc(NC(C)=O)cc1)c1nc2ccccc2c(=O)n1\N=C\c1ccc(cc1)[N+]([O-])=O
Cc1c(Sc2cccc3ccccc23)n(C)c2nc(N)nc(N)c12
CCCCn1c(Sc2cccc(OC)c2)c(C)c2c(N)nc(N)nc12
Cc1c(Sc2ccc3ccccc3c2)n(C)c2nc(N)nc(N)c12
CCCn1c(Sc2cccc(OC)c2)c(C)c2c(N)nc(N)nc12
COc1cccc(Sc2c(C)c3c(N)nc(N)nc3n2C(C)C)c1
Cc1c(Sc2ccc(F)c(F)c2)[nH]c2nc(N)nc(N)c12
Cc1c2c(nc(nc2n(c1Sc3ccc(cc3)OC)C)N)N
Cc1c(Sc2ccc(OC(F)(F)F)cc2)n(C)c2nc(N)nc(N)c12
CCn1c2c(c(c1Sc3cccc(c3)OC)C)c(nc(n2)N)N
Cc1c(Sc2ccc(OC(F)(F)F)cc2)[nH]c2nc(N)nc(N)c12
Cc1c(Sc2ccc(F)c(F)c2)n(C)c2nc(N)nc(N)c12
Nc1nc(N)c2nc(CCCc3ccccc3)ccc2n1
Nc1nc(N)c2nc(\C=C\CCCc3ccccc3)ccc2n1
Nc1nc(N)c2nc(CCC(=O)c3ccccc3)ccc2n1
Nc1nc(N)c2nc(CCCCCc3ccccc3)ccc2n1
Nc1nc(N)c2nc(CCC(=O)CCc3ccccc3)ccc2n1
Nc1nc(N)c2nc(\C=C\C(=O)\C=C\c3ccccc3)ccc2n1
Nc1nc(N)c2nc(\C=C\C=C\c3ccccc3)ccc2n1
Nc1nc(N)c2nc(\C=C\Cc3ccccc3)ccc2n1
Nc1nc(N)c2nc(CCC(O)CCc3ccccc3)ccc2n1
Nc1nc(N)c2nc(CCC(O)c3ccccc3)ccc2n1
Nc1nc(N)c2nc(CCc3ccccc3)ccc2n1
Nc1nc(N)c2nc(CCCCc3ccccc3)ccc2n1
Nc1nc(N)c2nc(\C=C\C(=O)c3ccccc3)ccc2n1
COc1cc(cc(OC)c1OC)C(O)c1cnc(N)nc1N
COc1cc(cc(OC)c1OC)C(=C)c1cnc(N)nc1N
COc1cc(cc(OC)c1OC)C(=C/C)\c1cnc(N)nc1N
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1O
COc1cc(cc(OC)c1OC)C(C)c1cnc(N)nc1N
COc1ccccc1Cc1cnc(N)nc1N
Nc1ncc(Cc2ccccc2I)c(N)n1
NC(=O)COc1ccccc1Cc1cnc(N)nc1N
Cc1ccccc1Cc1cnc(N)nc1N
COCc1ccccc1Cc1cnc(N)nc1N
CS(=O)(=O)Oc1ccccc1Cc1cnc(N)nc1N
CCOc1ccccc1Cc1cnc(N)nc1N
Nc1ncc(Cc2ccccc2OCc2ccccc2)c(N)n1
Nc1ncc(Cc2ccccc2O)c(N)n1
Nc1ncc(Cc2ccccc2Br)c(N)n1
Nc1ncc(Cc2ccccc2F)c(N)n1
Nc1ncc(Cc2ccccc2OCC=C)c(N)n1
CCCCOc1ccccc1Cc1cnc(N)nc1N
CCCCCCOc1ccccc1Cc1cnc(N)nc1N
Nc1ncc(Cc2ccccc2Cl)c(N)n1
O\N=C1/Cc2ccc(Oc3cc(C\C(=N/O)C(=O)N\C=C\c4cc(Br)c(Oc5cc(CCNC1=O)cc(Br)c5O)c(Br)c4)cc(Br)c3O)c(Br)c2 |t:19|
CCOC(=O)C1=C(C)N=C(NC1c1ccccc1OC)SCCC(O)=O |c:5,8|
CC(=O)C1=C(C)N=C(NC1c1ccccc1)SCCC(O)=O |c:3,6|
CCOC(=O)C(\SC1=NC(C(C(=O)OCC)=C(C)N1)c1ccccc1)=C\c1ccc(OC)cc1 |t:7,15|
CCOC(=O)CSC1=NC(C(C(=O)OCC)=C(C)N1)c1ccccc1 |t:7,15|
CCOC(=O)C1=C(C)N=C(NC1c1ccccc1)SCC(=O)c1ccc(Cl)c(c1)[N+]([O-])=O |c:5,8|
CC(=O)C1=C(C)N=C(NC1c1cccc(O)c1)SCCC(O)=O |c:3,6|
CCOC(=O)C1=C(C)NC(=S)NC1c1ccccc1 |c:5|
CCOC(=O)CSC1=NC(C(C(=O)OCC)=C(C)N1)c1ccccc1OC |t:7,15|
CCOC(=O)C1=C(C)NC(=S)NC1\C=C/c1ccccc1 |c:5|
CC(=O)C1=C(C)NC(=S)NC1c1cccc(O)c1 |c:3|
CCOC(=O)C1=C(C)NC(=S)NC1c1ccccc1OC |c:5|
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)N(C)Cc1ccccc1
COc1cc(C)c2c(OC3CCCCC3C(F)(F)F)c(OC)cc(NC(C)CCCN)c2n1
NC(=N)c1ccc(cc1)N1CCN(CC1)c1ccc(cc1)-c1nc2ccccc2[nH]1
COc1cc(Cc2cnc(N)nc2N)cc(C#CCCC(O)=O)c1OC
CCc1nc2nc(N)nc(N)c2nc1CC
CC(C)CN(C(=O)Nc1ccc(CCC(O)=O)cc1Cc1ccccc1)C(=O)c1ccc(OCC(O)=O)c(Cc2ccccc2)c1
CC1(C)N=C(N)N=C(N)N1c1cccc(CCCCc2ccc(cc2)S(F)(=O)=O)c1 |t:3,6|
CCOc1ccc(cc1)N1C(N)=NC(N)=NC1(C)C |c:12,15|
CC1(C)N=C(N)N=C(N)N1c1cccc(CCCCc2ccccc2)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(OCCCOc2ccccc2)c(Cl)c1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(CCCCc2ccc(Cl)cc2Cl)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(CN)cc1 |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1cccc(c1)C(=O)Nc1ccc(cc1)S(F)(=O)=O |t:3,6|
CC1(C)N=C(N)N=C(N)N1c1ccc(CCCCCCc2ccc(cc2)S(F)(=O)=O)cc1 |t:3,6|
NC1=NC(N(C(N)=N1)c1ccc(cc1)S(N)(=O)=O)c1ccc(Cl)cc1 |c:6,t:1|
CC1(C)N=C(N)N=C(N)N1c1cccc(CN)c1 |t:3,6|
Nc1nnc(c(N)n1)-c1cccc(Cl)c1Cl
CN(C)c1ccc(cc1)N1C(N)=NC(N)=NC1(C)C
Nc1nc(N)c2nc(\C=C\c3ccccc3)ccc2n1
Cc1ccc(\C=C\c2ccc3nc(N)nc(N)c3n2)cc1
CCc1ccc(\C=C\c2ccc3nc(N)nc(N)c3n2)cc1
CC(C)c1ccc(\C=C\c2ccc3nc(N)nc(N)c3n2)cc1
Nc1nc(N)c2nc(\C=C\c3ccc(F)cc3)ccc2n1
Nc1nc(N)c2nc(\C=C\c3ccc(Cl)cc3)ccc2n1
Nc1nc(N)c2nc(\C=C\c3ccc(Br)cc3)ccc2n1
COc1ccc(\C=C\c2ccc3nc(N)nc(N)c3n2)cc1
COc1cccc(\C=C\c2ccc3nc(N)nc(N)c3n2)c1
COc1ccccc1\C=C\c1ccc2nc(N)nc(N)c2n1
COc1cc(\C=C\c2ccc3nc(N)nc(N)c3n2)cc(OC)c1OC
Cc1ccc(CCc2ccc3nc(N)nc(N)c3n2)cc1
CCc1ccc(CCc2ccc3nc(N)nc(N)c3n2)cc1
CC(C)c1ccc(CCc2ccc3nc(N)nc(N)c3n2)cc1
Nc1nc(N)c2nc(CCc3ccc(F)cc3)ccc2n1
Nc1nc(N)c2nc(CCc3ccc(Cl)cc3)ccc2n1
Nc1nc(N)c2nc(CCc3ccc(Br)cc3)ccc2n1
COc1ccc(CCc2ccc3nc(N)nc(N)c3n2)cc1
COc1cccc(CCc2ccc3nc(N)nc(N)c3n2)c1
COc1ccccc1CCc1ccc2nc(N)nc(N)c2n1
COc1cc(CCc2ccc3nc(N)nc(N)c3n2)cc(OC)c1OC
CCc1nc(N)nc(N)c1OCCCOc1cccc(c1)-c1c(N)nc(N)nc1CC
CCc1nc(N)nc(N)c1OCCCOc1ccc(cc1)-c1c(N)nc(N)nc1CC
CCc1nc(N)nc(N)c1-c1ccc(OCCCOc2ccc(cc2)-c2c(N)nc(N)nc2CC)cc1
Cc1c(c(nc(n1)N)N)OCCCOc2cc(c(cc2Cl)Cl)Cl
CCc1nc(N)nc(N)c1-c1cccc(Cl)c1
CCc1nc(N)nc(N)c1OCCCOc1ccc(cc1)-c1c(N)nc(N)nc1CC
CC(=O)Nc1ccc(cc1)S(=O)(=O)NC(Cc1ccccc1)c1nc2ccccc2c(=O)n1\N=C\c1ccc(C)cc1
CC(=O)Nc1ccc(cc1)S(=O)(=O)NC(Cc1ccccc1)c1nc2ccccc2c(=O)n1\N=C\c1ccc(Br)cc1
CC(=O)Nc1ccc(cc1)S(=O)(=O)NC(Cc1ccccc1)c1nc2ccccc2c(=O)n1\N=C\c1cccc(Cl)c1
CC(=O)Nc1ccc(cc1)S(=O)(=O)NC(Cc1ccccc1)c1nc2ccccc2c(=O)n1\N=C\c1cccc(F)c1
CC(=O)Nc1ccc(cc1)S(=O)(=O)NC(Cc1ccccc1)c1nc2ccccc2c(=O)n1\N=C\c1ccc(F)cc1
Nc1nc2[nH]c(CCNC(=O)c3cccc(c3)C(=O)NCc3ccncc3)cc2c(=O)[nH]1
Nc1nc2[nH]c(CCNC(=O)c3ccc(cc3)C(=O)NCc3cccnc3)cc2c(=O)[nH]1
Nc1nc2[nH]c(CCNC(=O)c3ccc(cc3)C(=O)NCc3ccccn3)cc2c(=O)[nH]1
Nc1nc2[nH]c(CCNC(=O)c3ccc(cc3)C(=O)NCc3ccncc3)cc2c(=O)[nH]1
Nc1nc2[nH]c(CCNC(=O)c3cccc(c3)C(=O)NCc3ccccn3)cc2c(=O)[nH]1
Nc1nc2[nH]c(CCNC(=O)c3cccc(c3)C(=O)NCc3cccnc3)cc2c(=O)[nH]1
O=C(OC[C@@H]1CO1)c1cccc2c1[nH]c1ccccc1c2=O |r|
CC1=NN(C(=O)\C1=C/c1cn(CC(O)Cn2c3ccccc3c(=O)c3ccccc23)c2ccccc12)c1cccc(Cl)c1 |t:1|
[#6]-[#7]-1-[#6](=O)-[#7](-[#6])-[#6](=O)\[#6](=[#6]\c2cn(-[#6]-[#6](-[#8])-[#6]-n3c4ccccc4c(=O)c4ccccc34)c3ccccc23)-[#6]-1=O
OC(Cn1cc(\C=C2/C(=O)Nc3ccccc23)c2ccccc12)Cn1c2ccccc2c(=O)c2ccccc12
C[C@H](NC(=O)CNC(=O)c1cccc2c1[nH]c1ccccc1c2=O)C(O)=O |r|
O=c1c2ccccc2n(CC2CO2)c2ccccc12
CC(=O)c1c(C)n(Cc2ccccc2)c2ccc(OCCCC(O)=O)cc12
CC(C)N(c1ccccc1)c1ccc2nc(N)nc(N)c2n1
Cc1ccc(Nc2ccc3nc(N)nc(N)c3n2)cc1
Nc1nc(N)c2nc(Nc3ccc(F)c(F)c3)ccc2n1
Nc1nc(N)c2nc(Nc3cc(F)c(F)c(F)c3)ccc2n1
CCN(c1ccccc1)c1ccc2nc(N)nc(N)c2n1
CCCN(c1ccccc1)c1ccc2nc(N)nc(N)c2n1
Nc1nc(N)c2nc(Nc3cccc4ccccc34)ccc2n1
CCCCN(c1ccccc1)c1ccc2nc(N)nc(N)c2n1
Nc1nc(N)c2nc(Nc3ccc(O)cc3)ccc2n1
Nc1nc(N)c2nc(Nc3ccc(OC(F)(F)F)cc3)ccc2n1
Nc1nc(N)c(c(CCCCCOc2ccccc2)n1)-c1cccc(Cl)c1
Nc1nc(N)c(c(CCCCOc2cccc(OCC(O)=O)c2)n1)-c1cccc(Cl)c1
CCc1nc(N)nc(N)c1-c1ccccc1
Nc1nc(N)c(c(CCc2ccccc2OCc2ccccc2)n1)-c1cccc(Cl)c1
CCOC(=O)CCCOc1ccccc1CCc1nc(N)nc(N)c1-c1ccccc1
CCOC(=O)CCCOc1ccccc1CCc1nc(N)nc(N)c1-c1cccc(Cl)c1
Nc1nc(N)c(c(CCCOc2ccccc2)n1)-c1cccc(Cl)c1
Nc1nc(N)c(c(CCCCOc2ccccc2)n1)-c1ccccc1
Nc1nc(N)c(c(CCCCOc2ccccc2)n1)-c1cccc(Cl)c1
Nc1nc(N)c(c(COc2cccc(OCC(O)=O)c2)n1)-c1cccc(Cl)c1
Nc1nc(N)c(c(COc2cccc(OCCCC(O)=O)c2)n1)-c1ccccc1
Nc1nc(N)c(c(CCCOc2cccc(OCC(O)=O)c2)n1)-c1ccccc1
Nc1nc(N)c(c(CCCOc2cccc(OCC(O)=O)c2)n1)-c1cccc(Cl)c1
Nc1nc(N)c(c(CCCCOc2cccc(OCC(O)=O)c2)n1)-c1ccccc1
Nc1nc(N)c(c(CCCOc2cccc(OCCCC(O)=O)c2)n1)-c1cccc(Cl)c1
Nc1nc(N)c(c(CCCCOc2cccc(OCCCC(O)=O)c2)n1)-c1ccccc1
Nc1nc(N)c(c(CCc2ccccc2OCc2ccccc2)n1)-c1ccccc1
Nc1nc(N)c(c(COc2cccc(OCC(O)=O)c2)n1)-c1ccccc1
Nc1nc(N)c(c(CCc2ccccc2OCCCc2ccccc2)n1)-c1ccccc1
Nc1nc(N)c(c(CCCOc2ccccc2)n1)-c1ccccc1
Nc1nc(N)c(c(CCCCCOc2ccccc2)n1)-c1ccccc1
Nc1nc(N)c(c(COc2cccc(OCCCC(O)=O)c2)n1)-c1cccc(Cl)c1
Nc1nc(N)c(c(CCCOc2cccc(OCCCC(O)=O)c2)n1)-c1ccccc1
Nc1nc(N)c(c(CCCCOc2cccc(OCCCC(O)=O)c2)n1)-c1cccc(Cl)c1
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2ccncc2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2ccccn2)c(N)n1
CCc1nc(N)nc(N)c1N1CCN(CC1)c1cccc(c1)-c1ccccc1
Cc1nc(N)nc(N)c1N1CCN(CC1)c1cccc(c1)-c1ccccc1
Nc1ncc(N2CCN(CC2)c2cccc(OC(F)(F)F)c2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(Cl)c2)c(N)n1
Nc1ncc(N2CCN(CC2)c2ccc(cc2)-c2ccccc2)c(N)n1
Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2cccnc2)c(N)n1
Nc1ncc(N2CCN(CC2)c2ccccc2Cl)c(N)n1
Cc1ccccc1N1CCN(CC1)c1cnc(N)nc1N
c1cc(cc(c1)O)C2=C(C(=O)c3cc(ccc3O2)O)O
CCc1nc(N)nc(N)c1C#C[C@H](C)c1cc(OC)cc(c1)-c1ccncc1 |r|
CCc1nc(N)nc(N)c1C#CC(C)c1cc(ccc1OC)-c1ccncc1
CCc1nc(N)nc(N)c1C#CC(C)c1cc2OCOc2c(c1)-c1ccncc1
CCc1nc(N)nc(N)c1C#C[C@H](C)c1cc(ccc1OC)-c1ccc(cc1)C(O)=O |r|
CC(=O)c1c(C)n(Cc2ccccc2)c2ccc(OCc3cn(nn3)-c3ccc(Br)cc3)cc12
CC(=O)c1c(C)n(Cc2ccccc2)c2ccc(OCc3cn(nn3)-c3cccc(Cl)c3)cc12
Cn1cc(c2c1cccc2)C[C@@H](C(=O)O)N
c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N
N[C@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
Cc1cccc(c1C)Nc2ccccc2C(=O)O
c1ccc(cc1)C(=O)NCC(=O)O
CCc1cccc2c3CCOC(CC)(CC(O)=O)c3[nH]c12
OC(=O)c1cc(ccc1O)-c1ccccc1
OC(=O)c1cc(ccc1O)-c1ccc(F)cc1F
c1ccc(c(c1)CC(=O)O)Nc2c(cccc2Cl)Cl
OC(=O)CCC(=O)c1ccc(cc1)-c1ccccc1
CC(C)Cc1ccc(cc1)[C@H](C)C(=O)O
C[C@@H](c1ccc2cc(ccc2c1)OC)C(=O)O
C[C@H](c1ccc2cc(ccc2c1)OC)C(=O)O
c1cc(ccc1C(=O)N[C@@H](CCC(=O)O)C(=O)O)N
c1cnc(nc1N)N
[H]/N=C(/N)\N/C(=N/[H])/NCCc1ccccc1
[#6]-[#7](-[#6])-[#6](=[#7])\[#7]=[#6](\[#7])-[#7]
Nc1nc2[nH]cc(CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c2c(=O)[nH]1
COC(=O)c1cccc(COc2ccccc2)c1
COC(=O)c1cccc(COc2ccc(OC)cc2)c1
COC(=O)c1cccc(COc2ccc(cc2)[N+]([O-])=O)c1
COC(=O)c1cccc(CSc2ccccc2)c1
COC(=O)c1cccc(OCc2ccccc2)c1
COC(=O)c1ccc(COc2ccccc2)cc1
COC(=O)c1ccc(COc2ccc(OC)cc2)cc1
COc1ccc(OCc2cccc(c2)C(O)=O)cc1
OC(=O)c1cccc(COc2ccc(O)cc2)c1
OC(=O)c1cccc(COc2ccc(cc2)[N+]([O-])=O)c1
OC(=O)c1cccc(CNc2ccccc2)c1
OC(=O)c1cccc(CSc2ccccc2)c1
OC(=O)c1cccc(OCc2ccccc2)c1
OC(=O)c1ccc(COc2ccccc2)cc1
COc1ccc(OCc2ccc(cc2)C(O)=O)cc1
C(Oc1ccccc1)c1cccc(c1)-c1nnn[nH]1
COC(=O)c1cccc(c1)-n1cc(COc2ccccc2)nn1
OC(=O)c1cccc(c1)-n1cc(COc2ccccc2)nn1
Nc1nc(N)c2nc-3c(nc2n1)-c1cccc2cccc-3c12
Nc1nc(N)c2nc3c4ccccc4c4ccccc4c3nc2n1
Nc1nc(N)c2nc3c4cccnc4c4ncccc4c3nc2n1
Nc1nc(N)c2nc(-c3ccccc3)c(nc2n1)-c1ccccc1
Nc1nc(N)c2nc(-c3ccco3)c(nc2n1)-c1ccco1
Nc1nc(N)c2nc(-c3cccs3)c(nc2n1)-c1cccs1
CCc1c(c(nc(n1)N)N)OCCCOc2ccccc2CCC(=O)O
CC1=C(C(NC(=O)N1)c1ccccc1)C(=O)Nc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O |t:1|
CC1=C(C(NC(=O)N1)c1ccc(cc1)[N+]([O-])=O)C(=O)Nc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O |t:1|
CC1=C(C(NC(=O)N1)c1ccc(Cl)cc1)C(=O)Nc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O |t:1|
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OCCNc1ccc(cc1)C(=O)NC(C(C)C)C(O)=O
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OCCNc1ccc(cc1)C(=O)NC(Cc1cc2ccccc2[nH]1)C(O)=O
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OCCNc1ccc(cc1)C(=O)NC(Cc1ccccc1)C(O)=O
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OCCNc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC(=O)CNC(CC(C)C)C(O)=O
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC(=O)CNC(Cc1cc2ccccc2[nH]1)C(O)=O
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC(=O)CNC(Cc1ccccc1)C(O)=O
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC(=O)CNC(CCC(O)=O)C(O)=O
OC(=O)C1CCN(CC1)C(=O)c1ccc(Nc2cnc3cc(ccc3n2)C(F)(F)F)cc1
Nc1cc(cc2nc(c(Nc3ccc(cc3)C(=O)N3CCC(CC3)C(O)=O)nc12)-c1ccccc1)C(F)(F)F
CCOC(=O)c1nc2ccccc2nc1Nc1ccc(cc1)C(=O)N1CCC(CC1C(=O)OC)C(=O)OC
CC1N=C(N)N=C(N)N1OCCCOc1cc(Cl)c(Cl)cc1Cl
NC1=NC(N(OCCCOc2cc(Cl)c(Cl)cc2Cl)C(N)=N1)c1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCCOc1ccc(Cl)cc1
CC1N=C(N)N=C(N)N1OCCCOc1ccc(Cl)cc1
CC1(N=C(N=C(N1OCCCOc2cccc(c2Cl)Cl)N)N)C
CC1N=C(N)N=C(N)N1OCCCOc1cccc(Cl)c1Cl
CC1(N=C(N=C(N1OCCCOc2ccc(cc2Cl)F)N)N)C
CC1N=C(N)N=C(N)N1OCCCOc1ccc(F)cc1Cl
CC1(C)N=C(N)N=C(N)N1OCCCOc1ccccc1
CC1(C)NC(N)=NC(=N)N1OCCCCOc1ccccc1
CC1(C)NC(N)=NC(=N)N1OCCc1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCCc1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCCCc1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCSc1ccc(Cl)cc1
CC1(C)N=C(N)N=C(N)N1OCCCSc1ccc(Cl)cc1
CC1(C)N=C(N)N=C(N)N1OCCCSc1ccccc1Cl
CC1(C)N=C(N)N=C(N)N1OCCCSc1cccc(Cl)c1
CC1(C)NC(N)=NC(=N)N1OCCCSc1ccccc1
CC1(C)N=C(N)N=C(N)N1OCCCNc1ccc(Cl)c(Cl)c1
Cc1ccc(C)c(NCCCON2C(N)=NC(N)=NC2(C)C)c1
CN(CCCON1C(N)=NC(N)=NC1(C)C)c1ccc(Cl)cc1
CN(CCCON1C(N)=NC(N)=NC1(C)C)c1ccc(Cl)c(Cl)c1
CCN(CC)CCCON1C(N)=NC(N)=NC1(C)C
Cc1ccc(cc1)-c1c(CN2CCCCC2)nc2scc(C(O)=O)n12
CCC(=O)NNC(=O)c1csc2ncc(-c3ccc(C)cc3)n12
CC(=O)NNC(=O)c1csc2ncc(-c3ccc(Br)cc3)n12
Cc1ccc(cc1)-c1c(CN2CCOCC2)nc2scc(C(=O)NN)n12
COc1ccc(cc1)-c1c(CN2CCOCC2)nc2scc(C(=O)NN)n12
NNC(=O)c1csc2nc(CN3CCOCC3)c(-c3ccc(Br)cc3)n12
CN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O
COC(=O)C1CCN(CC1)C(=O)c1ccc(NCc2cnc3nc(N)nc(N)c3n2)cn1
CCOC(=O)C1CCCN1C(=O)c1ccc(NCc2cnc3nc(N)nc(N)c3n2)cc1
CCN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(cc3)C(=O)N4CCC(CC4)C(=O)OC
COC(=O)C1CCN(CC1)C(=O)c1ccc(cc1)N(CC#C)Cc1cnc2nc(N)nc(N)c2n1
COC(=O)C1CCN(CC1)C(=O)c1ccc(cc1)N(Cc1ccccc1)Cc1cnc2nc(N)nc(N)c2n1
COC(=O)C1CCN(CC1)C(=O)c1ccc(SCc2cnc3nc(N)nc(N)c3n2)nc1
COC(=O)C1CCN(CC1)C(=O)c2ccc(cc2)N(CCCO)Cc3cnc4c(n3)c(nc(n4)N)N
COC(=O)C1CCN(CC1)C(=O)Cc1ccc(NCc2cnc3nc(N)nc(N)c3n2)cc1
COC(=O)C1CCN(CC1)C(=O)c1cccc(NCc2cnc3nc(N)nc(N)c3n2)c1
Nc1nc(N)c2nc(cnc2n1)C(=O)NCc1ccccc1
Nc1nc(N)c2nc(cnc2n1)C(=O)NCc1cccc(c1)C(F)(F)F
CCOC(=O)C1CCN(CC1)C(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1
CCCOC(=O)C1CCN(CC1)C(=O)c1ccc(cc1)N(C)Cc1cnc2nc(N)nc(N)c2n1
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N1CCCCC1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)c3ccccc3)cnc2n1
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NCCc3ccccc3)cnc2n1
COc1ccc(CNC(=O)c2ccc(CNCc3cnc4nc(N)nc(N)c4n3)cc2)cc1
COc1ccc(CNC(=O)c2ccc(CNCc3cnc4nc(N)nc(N)c4n3)cc2)cc1OC
Nc1nc(N)c2nc(CNCc3ccc(Oc4ccccc4)cc3)cnc2n1
COc1ccc(Oc2ccc(CNCc3cnc4nc(N)nc(N)c4n3)cc2)cc1
COc1cc(Oc2ccc(CNCc3cnc4nc(N)nc(N)c4n3)cc2)cc(OC)c1OC
NC(=O)C1CCN(CC1)C(=O)Cc1ccc(cc1)N(CCCO)Cc1cnc2nc(N)nc(N)c2n1
NC(=O)C1CCCN1C(=O)Cc1ccc(cc1)N(CCCO)Cc1cnc2nc(N)nc(N)c2n1
CCOC(=O)C1CCN(CC1)C(=O)c1ccc(cc1)N(CC)Cc1cnc2nc(N)nc(N)c2n1
CCN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)c1ccccc1
COc1ccc(Oc2ccc(CN(Cc3ccccc3)Cc3cnc4nc(N)nc(N)c4n3)cc2)cc1
COc1ccc(Oc2ccc(CN(C)Cc3cnc4nc(N)nc(N)c4n3)cc2)cc1
[H][C@@](CCC(O)=O)(NC(=O)c1ccc(cc1)C(CC#C)Cc1cnc2nc(N)nc(N)c2n1)C(O)=O |r|
CC1=NC(=O)c2cc(ccc2N1)CN(C)c3ccc(s3)C(=O)N[C@@H](CCC(=O)O)C(=O)O
COc1nc(N)nc(Nc2ccccc2)c1\N=C\c1ccccc1
COc1nc(N)nc(Nc2ccccc2)c1\N=C\c1ccc(C)cc1
COc1nc(N)nc(Nc2ccccc2)c1\N=C\c1ccncc1
COc1nc(N)nc(Nc2ccccc2)c1\N=C\c1ccccc1O
COc1nc(N)nc(Nc2ccccc2)c1\N=C\c1ccc(cc1)C(F)(F)F
Nc1nc2n(c(nc2c(=O)[nH]1)-c1ccc(Br)cc1)-c1ccccc1
Cc1ccc(cc1)-c1nc2c(nc(N)[nH]c2=O)n1-c1ccccc1
CC(C)c1ccc(cc1)-c1nc2c(nc(N)[nH]c2=O)n1-c1ccccc1
Nc1nc2n(c(nc2c(=O)[nH]1)-c1ccccc1O)-c1ccccc1
Nc1nc2n(c(nc2c(=O)[nH]1)-c1ccc2OCOc2c1)-c1ccccc1
COc1cc(cc(OC)c1OC)-c1nc2c(nc(N)[nH]c2=O)n1-c1ccccc1
Nc1nc(N)c2cc(ccc2n1)C(F)(F)F
Nc1nc(N)c2c3ccn(Cc4ccc5ccccc5c4)c3ccc2n1
c1c(cc(c(c1O)O)O)[C@@H]2[C@@H](Cc3c(cc(cc3O2)O)O)OC(=O)c4cc(c(c(c4)O)O)O
CCCCc1nc(Cl)c([nH]1)C1NC(=O)NC(C)=C1C(=O)Nc1ccc(F)cc1 |c:17|
O=c1[nH]c2ncn(Cc3ccccc3)c2c(=O)[nH]1
COc1ccc(cc1)-c1nc(O)c2ccccc2n1
Nc1nc(N)c2c3ccn(Cc4cccc(c4)[N+]([O-])=O)c3ccc2n1
Cc1cc(c(C)cc1CSC(=N)NC(N)=N)[N+]([O-])=O
Nc1ccc(Cn2ccc3c2ccc2nc(N)nc(N)c32)cc1
CC(=O)Nc1ccc(\C=C\c2ccc(cc2S(O)(=O)=O)N=C=S)c(c1)S(O)(=O)=O
c1cc(c(cc1O)O)/C=C/c2cc(cc(c2)O)O
[#6]-[#6]-[#6]-c1cc(-[#7])cc(-[#7])c1-[#6]-c1cc(-[#8]-[#6])c(-[#8]-[#6])c(\[#6]=[#6]\[#6](=O)-[#7]-2-[#7]=[#6]-c3ccccc3-[#6]-2\[#6]=[#6](\[#6])-[#6])c1 |c:27|
CCc1nc(N)nc(N)c1C#C[C@@H](C)c1cc(OC)cc(c1)-c1ccncc1 |r|
[H][C@@]12CC[C@@H](CC)[C@]3(Cc4c(O3)c3COC(=O)c3cc4O)[C@@]1(CC)CC[C@@H](O)C2(CC)CC |r|
OC(=O)CN1C(=S)S\C(C1=O)=C1/C(=O)N(Cc2ccc(Cl)cc2)c2ccccc12
Cc1ccc(CN2C(=O)\C(=C3/SC(=S)N(C(O)=O)C3=O)c3ccccc23)cc1
OC(=O)CN1C(=S)S\C(C1=O)=C1/C(=O)N(Cc2ccccc2Cl)c2ccccc12
OC(=O)CCN1C(=S)S\C(C1=O)=C1/C(=O)N(Cc2ccc(F)cc2)c2ccccc12
NS(=O)(=O)c1ccc(cc1)N1C(=O)\C(=C\c2ccc(OC(=O)c3ccccc3)cc2)N=C1c1ccccc1 |c:33|
COc1cc(\C=C2/N=C(N(C2=O)c2ccc(cc2)S(N)(=O)=O)c2ccccc2)ccc1OC(=O)c1ccccc1 |c:7|
COc1cc(\C=C2/N=C(N(C2=O)c2ccc(cc2)C(O)=O)c2ccccc2)ccc1OC(=O)c1ccccc1 |c:7|
Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
CN1CCN(CCC(=O)NNC(=O)c2csc(NC(C)=O)n2)CC1
CC(=O)Nc1nc(cs1)C(=O)NNC(=O)CCN1CCOCC1
CC(=O)Nc1nc(cs1)C(=O)NNC(=O)CCN1CCCCC1
CC(=O)OC[C@H]1O[C@@H](NC(=S)Nc2nc(cs2)-c2ccc(Cl)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |r|
COc1ccc(cc1)-c1csc(NC(=S)N[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)n1 |r|
COc1ccc(cc1[N+]([O-])=O)-c1csc(NC(=S)N[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)n1 |r|
CCc1nc(N)nc(N)c1Cc1ccc(cc1)-c1ccc(cc1)C(=O)OC
CCc1nc(N)nc(N)c1Cc1ccc(cc1)-c1ccc(cc1)C(O)=O
CCc1nc(N)nc(N)c1Cc1ccc(cc1)-c1cccc(c1)C(=O)OC
CCc1nc(N)nc(N)c1Cc1ccc(cc1)-c1cccc(c1)C(O)=O
CCc1nc(N)nc(N)c1Cc1cccc(c1)-c1ccc(cc1)C(=O)OC
CCc1nc(N)nc(N)c1Cc1cccc(c1)-c1ccc(cc1)C(O)=O
CCc1nc(N)nc(N)c1Cc1cccc(c1)-c1cccc(c1)C(=O)OC
CCc1nc(N)nc(N)c1Cc1cccc(c1)-c1cccc(c1)C(O)=O
O=C(CN1CCN(CC1)C(c1ccccc1)c1ccccc1)Nc1nnc(COc2ccc3ccccc3c2)s1
Oc1ccccc1N1CCN(CC(=O)Nc2nnc(COc3ccc4ccccc4c3)s2)CC1
Clc1ccc2c(ccnc2c1)N1CCN(CC(=O)Nc2nnc(COc3ccc4ccccc4c3)s2)CC1
Cc1ccc(cc1)S(=O)(=O)NC(=S)Nc1nncs1
CCc1nnc(NC(=S)NS(=O)(=O)c2ccc(C)cc2)s1
CCCCCc1nnc(NC(=S)NS(=O)(=O)c2ccc(C)cc2)s1
CC(C)CCc1nnc(NC(=S)NS(=O)(=O)c2ccc(C)cc2)s1
Nc1nc(N)c2c3ccn(Cc4ccc5ccccc5n4)c3ccc2n1
Nc1nc(N)c2c3ccn(Cc4cc5ccccc5s4)c3ccc2n1
Nc1nc(N)c2c3ccn(Cc4nc5ccccc5o4)c3ccc2n1
Nc1nc(N)c2c3ccn(Cc4nc5ccccc5s4)c3ccc2n1
Nc1nc(N)c2c3ccn(Cc4ccc5scnc5c4)c3ccc2n1
Nc1nc(N)c2c3ccn(Cc4cccc5scnc45)c3ccc2n1
Nc1nc(N)c2c3ccn(Cc4ccc(C(O)=O)c5ccccc45)c3ccc2n1
Nc1nc(N)c2c3ccn(Cc4ccc5cc(ccc5c4)C(O)=O)c3ccc2n1
Nc1nc(N)c2c3ccn(Cc4ccc5cc(ccc5n4)C(O)=O)c3ccc2n1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1I
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccc(C(C)C)cc1
CC(C)c1cc(OCC2CC2)c(I)cc1Oc1cnc(N)nc1N
CCCOc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1I
CCCCOc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1I
CCCCCOc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1I
CC(C)c1cc(OCC2CCC2)c(I)cc1Oc1cnc(N)nc1N
CC(C)c1cc(OCC2CCCC2)c(I)cc1Oc1cnc(N)nc1N
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccc(Cl)cc1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccc2ccccc2c1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccc(F)cc1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccc(C)cc1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccc(C(F)(F)F)cc1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccc(OC(F)(F)F)cc1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccc(C(=O)O)cc1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccc2c(c1)OCO2
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccc(C(C)(C)C)cc1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1cccc(C(F)(F)F)c1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1cc(F)cc(F)c1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1cc(Cl)cc(Cl)c1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccc(Cl)c(C(F)(F)F)c1
CCc1cc(Oc2cnc(N)nc2N)c(cc1OC)C(C)C
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1C1CC1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1CC(C)C
COc1ccc(Oc2cnc(N)nc2N)cc1-c1ccc(C(F)(F)F)cc1
COc1ccc(Oc2cnc(N)nc2N)cc1-c1ccc(OC(F)(F)F)cc1
Nc1ncc(-c2ccc(Cl)c([N+](=O)[O-])c2)c(N)n1
NCCCCCCNc1ccc(-c2cnc(N)nc2N)cc1[N+](=O)[O-]
Nc1ncc(c(N)n1)-c1cccc(Cl)c1
Nc1ncc(-c2ccc3ccccc3c2)c(N)n1
COc1cc(-c2cnc(N)nc2N)ccc1C
CC(C)c1ccc(-c2cnc(N)nc2N)cc1
Nc1ncc(-c2ccc(Cl)c(Cl)c2)c(N)n1
Nc1ncc(-c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c(N)n1
CCc1nc(N)nc(N)c1OCCCOc1cccc(-c2ccccc2)c1
CCc1nc(N)nc(N)c1OCCCCOc1cccc(-c2ccccc2)c1
CCc1nc(N)nc(N)c1OCCCOc1ccc(-c2ccccc2)cc1
CCc1nc(N)nc(N)c1OCCCCOc1ccc(-c2ccccc2)cc1
CCOC(=O)c1ccc(-c2ccc(OCCCOc3c(N)nc(N)nc3CC)cc2)cc1
CCc1nc(N)nc(N)c1OCCCOc1ccc(-c2ccc(C(=O)O)cc2)cc1
CCOC(=O)c1ccc(-c2ccc(OCCCCOc3c(N)nc(N)nc3CC)cc2)cc1
CCc1nc(N)nc(N)c1OCCCCOc1ccc(-c2ccc(C(=O)O)cc2)cc1
Brc1ccc(cc1)-c1c[nH]cn1
Cc1c(C(=O)O)cnn1-c1ccccc1
O=C(CCc1c[nH]c2ccccc12)Nc1c(C(=O)O)cnn1-c1ccccc1