Ligand |
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| Ligand Name: [[(2~{R})-2-[(4-bromophenyl)carbonylamino]-2-(2~{H}-1,2,3,4-tetrazol-5-yl)ethanoyl]amino]azanium | ||
| HET ID: FHT | PubChem: 145864183 | |
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: [NH3+]NC(=O)[C@@H](c1n[nH]nn1)NC(=O)c1ccc(cc1)Br | ||
| Standard InChI: InChI=1S/C10H10BrN7O2/c11-6-3-1-5(2-4-6)9(19)13-7(10(20)14-12)8-15-17-18-16-8/h1-4,7H,12H2,(H,13,19)(H,14,20)(H,15,16,17,18)/p+1/t7-/m1/s1 | ||
| Molecular Formula: C10H11BrN7O2+ | Mol. Weight: 341.14404 | Heavy Atoms: 20 |
| Charge: 1 | Is Chiral: True | logP: -0.5118 |
| HBD: 4 | HBA: 7 | TPSA: 140.3 |
| #Bonds: 26 | #Rotatable Bonds: 6 | Shape Complexity: 0.1 |
| Stereocomplexity: 0.1 | Ligand Type: Small Molecule | |
Binding Affinity |
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