Ligand |
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| Ligand Name: 5-methylphenazin-1(5H)-one | ||
| HET ID: 3J8 | PubChem: 6817 | |
| DrugBank: - | ChEMBL: CHEMBL2289232 | |
| Canonical SMILES: Cn1c2ccccc2nc2c1cccc2=O | ||
| Standard InChI: InChI=1S/C13H10N2O/c1-15-10-6-3-2-5-9(10)14-13-11(15)7-4-8-12(13)16/h2-8H,1H3 | ||
| Molecular Formula: C13H10N2O | Mol. Weight: 210.2313 | Heavy Atoms: 16 |
| Charge: 0 | Is Chiral: False | logP: 2.0867 |
| HBD: 0 | HBA: 3 | TPSA: 34.89 |
| #Bonds: 18 | #Rotatable Bonds: 0 | Shape Complexity: 0.07692308 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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| Database Name | Value |
| Binding MOAD | IC50 : 7000 nM |