Ligand |
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Ligand Name: 4-(4-fluorophenyl)-3-fluorosulfonyl-benzoic acid | ||
Ligand Type: non-polymer | ||
Ligand ID: COVPDB1027 | PubChem: 145946042 | |
Synonym(s):
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DrugBank: - | ChEMBL: CHEMBL4524407 | |
Canonical SMILES: OC(=O)c1ccc(-c2ccc(F)cc2)c(c1)S(F)(=O)=O | ||
Standard InChI: InChI=1S/C13H8F2O4S/c14-10-4-1-8(2-5-10)11-6-3-9(13(16)17)7-12(11)20(15,18)19/h1-7H,(H,16,17) | ||
Molecular Formula: C13H8F2O4S | Mol. Weight: 298.01114 | logP: 2.8491 |
HBD: 1 | HBA: 3 | |
#Rotatable Bonds: 3 | TPSA: 71.44 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Bcl-2-like protein 1 | Q07817 (B2CL1_HUMAN) | Homo sapiens (Human) | 6RNU | KBH |
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