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Ligand Download |
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| Ligand Name: (4bS,6S)-6-methoxy-1,4,6,7,9,10,12,13-octahydro-3H,5H-pyrano[4',3':3,4]pyrido[2,1-i]indol-3-one | ||
| HET ID: IZN | PubChem: 31762 | |
| DrugBank: - | ChEMBL: CHEMBL293950 | |
| Canonical SMILES: CO[C@H]1CC=C2[C@]3(C1)N(CC2)CCC1=C3CC(=O)OC1 | ||
| Standard InChI: InChI=1S/C16H21NO3/c1-19-13-3-2-12-5-7-17-6-4-11-10-20-15(18)8-14(11)16(12,17)9-13/h2,13H,3-10H2,1H3/t13-,16-/m0/s1 | ||
| Molecular Formula: C16H21NO3 | Mol. Weight: 275.34283 | Heavy Atoms: 20 |
| Charge: 0 | Is Chiral: True | logP: 1.7512 |
| HBD: 0 | HBA: 4 | TPSA: 38.77 |
| #Bonds: 24 | #Rotatable Bonds: 1 | Shape Complexity: 0.6875 |
| Stereocomplexity: 0.1875 | ||