 |
| Ligand Name:
N-[5-(2,3-dimethylphenyl)-1,6-naphthyridin-7-yl]acetamide |
| HET ID: 8JF |
PubChem:
146014962
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: CC(=O)Nc1cc2ncccc2c(n1)c1cccc(c1C)C |
| Standard InChI: InChI=1S/C18H17N3O/c1-11-6-4-7-14(12(11)2)18-15-8-5-9-19-16(15)10-17(21-18)20-13(3)22/h4-10H,1-3H3,(H,20,21,22) |
| Molecular Formula: C18H17N3O |
Mol. Weight: 291.34708 |
Heavy Atoms: 22 |
| Charge: 0 |
Is Chiral: False |
logP: 3.945 |
| HBD: 1 |
HBA: 4 |
TPSA: 54.88 |
| #Bonds: 24 |
#Rotatable Bonds: 3 |
Shape Complexity: 0.16666667 |
| Stereocomplexity: 0.0 |
Ligand Type: Small Molecule |