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| Ligand Name: (E)-1-(1-methyl-6-{4-[3-(4-methylpiperazin-1-yl)propoxy]-3-(trifluoromethyl)phenyl}-1H-imidazo[4,5-c]pyridin-4-yl)methanimine |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB753 |
PubChem:
25204335
|
Synonym(s):
- chembl1209144
- schembl1629664
- bdbm50323245
- 1-methyl-6-(4-(3-(4-methylpiperazin-1-yl)propoxy)-3-(trifluoromethyl)phenyl)-1h-imidazo[4,5-c]pyridine-4-carbonitrile
- 1-methyl-6-[4-[3-(4-methylpiperazin-1-yl)propoxy]-3-(trifluoromethyl)phenyl]imidazo[4,5-c]pyridine-4-carbonitrile
show 4 synonym(s)
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| DrugBank: - |
ChEMBL: CHEMBL1209144 |
| Canonical SMILES: CN1CCN(CCCOc2ccc(cc2C(F)(F)F)-c2cc3n(C)cnc3c(n2)C#N)CC1 |
| Standard InChI: InChI=1S/C23H25F3N6O/c1-30-7-9-32(10-8-30)6-3-11-33-21-5-4-16(12-17(21)23(24,25)26)18-13-20-22(19(14-27)29-18)28-15-31(20)2/h4-5,12-13,15H,3,6-11H2,1-2H3 |
| Molecular Formula: C23H25F3N6O |
Mol. Weight: 458.2042 |
logP: 3.54208 |
| HBD: 0 | HBA: 7 |
| #Rotatable Bonds: 6 | TPSA: 70.21 |