Ligand |
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Ligand Name: N-(2-sulfanylethyl)benzamide | ||
Ligand Type: non-polymer | ||
Ligand ID: COVPDB554 | PubChem: 11309882 | |
Synonym(s):
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DrugBank: - | ChEMBL: CHEMBL1738771 | |
Canonical SMILES: c1ccccc1C(=O)NCCS | ||
Standard InChI: InChI=1S/C9H11NOS/c11-9(10-6-7-12)8-4-2-1-3-5-8/h1-5,12H,6-7H2,(H,10,11) | ||
Molecular Formula: C9H11NOS | Mol. Weight: 181.05614 | logP: 1.3462 |
HBD: 2 | HBA: 2 | |
#Rotatable Bonds: 3 | TPSA: 29.1 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Carbonic anhydrase 2 | P00918 (CAH2_HUMAN) | Homo sapiens (Human) | 3M2Z | BFE |
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