In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2006 | 35 | Yes |
Popular Name: 2-[(3-cyano-4,6-diphenyl-2-pyridyl)sulfanyl]-N-(2,5-dimethoxyphenyl)-acetamide 2-[(3-cyano-4,6-diphenyl-2-pyrid…
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) | 5.80 | 12.1 | -17.31 | 1 | 6 | 0 | 84 | 481.577 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.80 | 12.26 | -45.96 | 2 | 6 | 1 | 85 | 482.585 | 8 | ↓ |