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Ligand Download |
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| Ligand Name: 4-methyl-2,3,4,5,6,7-hexahydrodicyclopenta[b,e]pyridin-8(1H)-imine | ||
| HET ID: 36X | PubChem: 904112 | |
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: N=c1c2CCCc2n(c2c1CCC2)C | ||
| Standard InChI: InChI=1S/C12H16N2/c1-14-10-6-2-4-8(10)12(13)9-5-3-7-11(9)14/h13H,2-7H2,1H3 | ||
| Molecular Formula: C12H16N2 | Mol. Weight: 188.26884 | Heavy Atoms: 14 |
| Charge: 0 | Is Chiral: False | logP: 1.5817 |
| HBD: 1 | HBA: 2 | TPSA: 28.78 |
| #Bonds: 16 | #Rotatable Bonds: 0 | Shape Complexity: 0.5833333 |
| Stereocomplexity: 0.0 | ||