 |
| Ligand Name:
5-(1~{H}-1,2,3,4-tetrazol-5-yl)quinolin-8-ol |
| HET ID: JX8 |
PubChem:
135921708
|
| DrugBank: - |
ChEMBL: CHEMBL1406064 |
| Canonical SMILES: Oc1ccc(c2c1nccc2)c1nnn[nH]1 |
| Standard InChI: InChI=1S/C10H7N5O/c16-8-4-3-7(10-12-14-15-13-10)6-2-1-5-11-9(6)8/h1-5,16H,(H,12,13,14,15) |
| Molecular Formula: C10H7N5O |
Mol. Weight: 213.19548 |
Heavy Atoms: 16 |
| Charge: 0 |
Is Chiral: False |
logP: 1.1205 |
| HBD: 2 |
HBA: 5 |
TPSA: 87.58 |
| #Bonds: 19 |
#Rotatable Bonds: 1 |
Shape Complexity: 0.0 |
| Stereocomplexity: 0.0 |
Ligand Type: Small Molecule |