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Ligand Download |
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| Ligand Name: 5-(furan-2-ylmethylamino)-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile | ||
| HET ID: LQG | PubChem: 137349703 | |
| DrugBank: - | ChEMBL: CHEMBL4063655 | |
| Canonical SMILES: N#Cc1ccc2n(c1NCc1ccco1)cnn2 | ||
| Standard InChI: InChI=1S/C12H9N5O/c13-6-9-3-4-11-16-15-8-17(11)12(9)14-7-10-2-1-5-18-10/h1-5,8,14H,7H2 | ||
| Molecular Formula: C12H9N5O | Mol. Weight: 239.23276 | Heavy Atoms: 18 |
| Charge: 0 | Is Chiral: False | logP: 1.87908 |
| HBD: 1 | HBA: 6 | TPSA: 79.15 |
| #Bonds: 20 | #Rotatable Bonds: 3 | Shape Complexity: 0.09090909 |
| Stereocomplexity: 0.0 | ||