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Ligand Download |
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| Ligand Name: (3~{Z})-3-(1-methylpyrrolidin-2-ylidene)indole | ||
| HET ID: 9UL | PubChem: 134110739, 12932187 | |
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: CN1CCC/C/1=C/1C=Nc2c1cccc2 | ||
| Standard InChI: InChI=1S/C13H14N2/c1-15-8-4-7-13(15)11-9-14-12-6-3-2-5-10(11)12/h2-3,5-6,9H,4,7-8H2,1H3/b13-11- | ||
| Molecular Formula: C13H14N2 | Mol. Weight: 198.26366 | Heavy Atoms: 15 |
| Charge: 0 | Is Chiral: False | logP: 2.2127 |
| HBD: 0 | HBA: 2 | TPSA: 15.6 |
| #Bonds: 17 | #Rotatable Bonds: 0 | Shape Complexity: 0.30769232 |
| Stereocomplexity: 0.0 | ||