In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 29 | Yes |
Popular Name: 2-(2-cyanoethyl)-1-(4-methoxyanilino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile 2-(2-cyanoethyl)-1-(4-methoxyani…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 4.87 | 12.29 | -22.62 | 1 | 6 | 0 | 86 | 381.439 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.87 | 12.7 | -41.28 | 2 | 6 | 1 | 87 | 382.447 | 5 | ↓ |