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BDBM12015 4-(AMINOSULFONYL)-N-[(4-FLUOROPHENYL)METHYL]-BENZAMIDE::4-fluoro-SBB::N-[(4-fluorophenyl)methyl]-4-sulfamoylbenzamide

SMILES: NS(=O)(=O)c1ccc(cc1)C(=O)NCc1ccc(F)cc1

InChI Key: InChIKey=IXDVPACDZDRCTN-UHFFFAOYSA-N

Data: 1 Kd

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 12015   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Carbonic Anhydrase II Mutant (F131V)


(Homo sapiens (Human))
BDBM12015
PNG
(4-(AMINOSULFONYL)-N-[(4-FLUOROPHENYL)METHYL]-BENZA...)
Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C14H13FN2O3S/c15-12-5-1-10(2-6-12)9-17-14(18)11-3-7-13(8-4-11)21(16,19)20/h1-8H,9H2,(H,17,18)(H2,16,19,20)
PDB
MMDB

B.MOAD
GoogleScholar
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/an/a 3.30n/an/an/a7.437



University of Pennsylvania



Assay Description
Inhibitor binding to CA II was determined using a fluorescence competition assay. Displacement of dansylamide and binding of the inhibitor was determ...


J Am Chem Soc 123: 9620-7 (2001)


Article DOI: 10.1021/ja011034p
BindingDB Entry DOI: 10.7270/Q2QZ286J
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)