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| Ligand Name: N-{1-[6-(phenylamino)pyrazin-2-yl]-1H-benzimidazol-6-yl}prop-2-enamide |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB179 |
PubChem:
11152476
|
Synonym(s):
- schembl1678616
- q27453604
- n-[3-(6-anilinopyrazin-2-yl)benzimidazol-5-yl]prop-2-enamide
show 2 synonym(s)
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| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: C=CC(=O)Nc(c1)ccc(c12)ncn2-c3cncc(n3)Nc4ccccc4 |
| Standard InChI: InChI=1S/C20H16N6O/c1-2-20(27)24-15-8-9-16-17(10-15)26(13-22-16)19-12-21-11-18(25-19)23-14-6-4-3-5-7-14/h2-13H,1H2,(H,23,25)(H,24,27) |
| Molecular Formula: C20H16N6O |
Mol. Weight: 356.13855 |
logP: 3.6836 |
| HBD: 2 | HBA: 6 |
| #Rotatable Bonds: 5 | TPSA: 84.73 |