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Ligand Download |
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| Ligand Name: 2-(1H-pyrazol-4-yloxy)-3H-pyrido[3,4-d]pyrimidin-4-one | ||
| HET ID: HA6 | PubChem: 114286470, 135567124 | |
| DrugBank: - | ChEMBL: CHEMBL3770916 | |
| Canonical SMILES: O=c1[nH]c(Oc2c[nH]nc2)nc2c1ccnc2 | ||
| Standard InChI: InChI=1S/C10H7N5O2/c16-9-7-1-2-11-5-8(7)14-10(15-9)17-6-3-12-13-4-6/h1-5H,(H,12,13)(H,14,15,16) | ||
| Molecular Formula: C10H7N5O2 | Mol. Weight: 229.19489 | Heavy Atoms: 17 |
| Charge: 0 | Is Chiral: False | logP: 0.8335 |
| HBD: 2 | HBA: 5 | TPSA: 96.55 |
| #Bonds: 21 | #Rotatable Bonds: 2 | Shape Complexity: 0.0 |
| Stereocomplexity: 0.0 | ||