BDBM50423787 4-Propyl-Benzenesulfonamide::4-Propylbenzenesulfonamide::CHEMBL148660

SMILES CCCc1ccc(cc1)S(=O)(=O)N

InChI Key InChIKey=CICCMHNIYTXWRF-UHFFFAOYSA-N

Data  2 KI  2 Kd

PDB links: 2 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50423787   

TargetCarbonic anhydrase 2(Human)
Istituto Italiano Di Tecnologia

Curated by ChEMBL
LigandPNGBDBM50423787(4-Propyl-Benzenesulfonamide | 4-Propylbenzenesulfo...)
Affinity DataKd:  5.78E+4nMAssay Description:Binding affinity to GST-fused human carbonic anhydrase-2 expressed in Escherichia coli BL21 codon plus cells assessed as dissociation constant by SPR...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2017
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetCarbonic anhydrase 2(Human)
Istituto Italiano Di Tecnologia

Curated by ChEMBL
LigandPNGBDBM50423787(4-Propyl-Benzenesulfonamide | 4-Propylbenzenesulfo...)
Affinity DataKd:  6.06E+4nMAssay Description:Binding affinity to GST-fused human carbonic anhydrase-2 expressed in Escherichia coli BL21 codon plus cells assessed as steady state dissociation co...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2017
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetCarbonic anhydrase 2(Human)
Istituto Italiano Di Tecnologia

Curated by ChEMBL
LigandPNGBDBM50423787(4-Propyl-Benzenesulfonamide | 4-Propylbenzenesulfo...)
Affinity DataKi:  0.0300nMAssay Description:Binding affinity to human carbonic anhydrase 2More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/23/2013
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetCarbonic anhydrase 2(Human)
Istituto Italiano Di Tecnologia

Curated by ChEMBL
LigandPNGBDBM50423787(4-Propyl-Benzenesulfonamide | 4-Propylbenzenesulfo...)
Affinity DataKi:  0.0300nMAssay Description:Binding affinity to human carbonic anhydrase 2More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/23/2013
Entry Details Article
PubMedPDB3D3D Structure (crystal)