BDBM50512391 CHEMBL4440088

SMILES [H][C@]12CCC(=C)[C@@H](\C=C\C3=CCOC3=O)[C@]1(C)CCC(=O)N[C@@]2(C)COC(=O)c1ccc(cc1)[N+]([O-])=O

InChI Key InChIKey=UDXIVCQNRDFLSN-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50512391   

TargetHexokinase-2(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50512391(CHEMBL4440088)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of recombinant human HK2 expressed in Escherichia coli BL21(DE3) using glucose as substrate preincubated for 10 mins followed by substrate...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMed