Ligand

Download

Ligand Name:   N-(2-(((5-CHLORO-2-PYRIDINYL)AMINO)SULFONYL)PHENYL)-4-(2-OXO-1(2H)-PYRIDINYL)BENZAMIDE
HET ID:   FXA PubChem:   24794406
DrugBank:   DB07800 ChEMBL:   CHEMBL402761
Canonical SMILES:   Clc1ccc(nc1)NS(=O)(=O)c1ccccc1NC(=O)c1ccc(cc1)n1ccccc1=O
Standard InChI:   InChI=1S/C23H17ClN4O4S/c24-17-10-13-21(25-15-17)27-33(31,32)20-6-2-1-5-19(20)26-23(30)16-8-11-18(12-9-16)28-14-4-3-7-22(28)29/h1-15H,(H,25,27)(H,26,30)
Molecular Formula:   C23H17ClN4O4S Mol. Weight:   480.9235 Heavy Atoms:   33
Charge:   0 Is Chiral:   False logP:   5.1658
HBD:   2 HBA:   8 TPSA:   118.54
#Bonds:   36 #Rotatable Bonds:   7 Shape Complexity:   0.0
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
Coagulation factor X P00742 (FA10_HUMAN) Homo sapiens 3CEN Ki : 5.5 nM PDBBind SHOW
Coagulation factor X P00742 (FA10_HUMAN) Homo sapiens 3CEN Ki : 5.5 nM BindingDB SHOW
Coagulation factor X P00742 (FA10_HUMAN) Homo sapiens 3CEN Ki : 5.5 nM Binding MOAD SHOW