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Ligand Download |
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| Ligand Name: 1-[(2~{R},5~{S})-2-(3-chlorophenyl)-5-methyl-morpholin-4-yl]-3-methoxy-propan-2-ol | ||
| HET ID: P1Q | PubChem: 39242981 | |
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: C[C@H]1CO[C@@H](CN1)c1cccc(c1)Cl | ||
| Standard InChI: InChI=1S/C11H14ClNO/c1-8-7-14-11(6-13-8)9-3-2-4-10(12)5-9/h2-5,8,11,13H,6-7H2,1H3/t8-,11-/m0/s1 | ||
| Molecular Formula: C11H14ClNO | Mol. Weight: 211.68796 | Heavy Atoms: 14 |
| Charge: 0 | Is Chiral: True | logP: 2.7182 |
| HBD: 1 | HBA: 2 | TPSA: 21.26 |
| #Bonds: 17 | #Rotatable Bonds: 1 | Shape Complexity: 0.45454547 |
| Stereocomplexity: 0.18181819 | ||