Ligand |
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| Ligand Name: PCM-0102432 | ||
| Ligand Type: non-polymer | ||
| Ligand ID: COVPDB1364 | PubChem: 96582197 | |
Synonym(s):
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| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: c1cccc(c12)[C@@H](CN(C2)C(=O)CCl)c3ccccc3 | ||
| Standard InChI: InChI=1S/C17H16ClNO/c18-10-17(20)19-11-14-8-4-5-9-15(14)16(12-19)13-6-2-1-3-7-13/h1-9,16H,10-12H2/t16-/m0/s1 | ||
| Molecular Formula: C17H16ClNO | Mol. Weight: 285.09204 | logP: 3.3995 |
| HBD: 0 | HBA: 1 | |
| #Rotatable Bonds: 2 | TPSA: 20.31 | |