Ligand |
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| Ligand Name: 9-(3-PHENYLMETHYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE | ||
| HET ID: 760 | PubChem: 1933 | |
| DrugBank: DB03672 | ChEMBL: CHEMBL215344 | |
| Canonical SMILES: c1ccc(cc1)CNc1c2CCCCc2nc2c1cccc2 | ||
| Standard InChI: InChI=1S/C20H20N2/c1-2-8-15(9-3-1)14-21-20-16-10-4-6-12-18(16)22-19-13-7-5-11-17(19)20/h1-4,6,8-10,12H,5,7,11,13-14H2,(H,21,22) | ||
| Molecular Formula: C20H20N2 | Mol. Weight: 288.3862 | Heavy Atoms: 22 |
| Charge: 0 | Is Chiral: False | logP: 4.7987 |
| HBD: 1 | HBA: 2 | TPSA: 24.92 |
| #Bonds: 25 | #Rotatable Bonds: 3 | Shape Complexity: 0.25 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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