 |
| Ligand Name:
4-[5-(7-fluoranylquinolin-4-yl)-1-methyl-imidazol-4-yl]-3,5-dimethyl-1,2-oxazole |
| HET ID: EHW |
PubChem:
138115348
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: Fc1ccc2c(c1)nccc2c1n(C)cnc1c1c(C)noc1C |
| Standard InChI: InChI=1S/C18H15FN4O/c1-10-16(11(2)24-22-10)17-18(23(3)9-21-17)14-6-7-20-15-8-12(19)4-5-13(14)15/h4-9H,1-3H3 |
| Molecular Formula: C18H15FN4O |
Mol. Weight: 322.3363 |
Heavy Atoms: 24 |
| Charge: 0 |
Is Chiral: False |
logP: 4.0462 |
| HBD: 0 |
HBA: 5 |
TPSA: 56.74 |
| #Bonds: 27 |
#Rotatable Bonds: 2 |
Shape Complexity: 0.16666667 |
| Stereocomplexity: 0.0 |
Ligand Type: Small Molecule |