Ligand |
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| Ligand Name: PCM-0102275 | ||
| Ligand Type: non-polymer | ||
| Ligand ID: COVPDB1345 | PubChem: 9167283 | |
Synonym(s):
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| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: ClCC(=O)N[C@@H](C)c1cccc(c12)cccc2 | ||
| Standard InChI: InChI=1S/C14H14ClNO/c1-10(16-14(17)9-15)12-8-4-6-11-5-2-3-7-13(11)12/h2-8,10H,9H2,1H3,(H,16,17)/t10-/m0/s1 | ||
| Molecular Formula: C14H14ClNO | Mol. Weight: 247.07639 | logP: 3.2558 |
| HBD: 1 | HBA: 1 | |
| #Rotatable Bonds: 3 | TPSA: 29.1 | |