In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2010 | 28 | Yes |
Popular Name: 1-(5-cyano-2-pyridyl)-N-(2-pyrrolidin-1-yl-3-pyridyl)piperidine-4-carboxamide 1-(5-cyano-2-pyridyl)-N-(2-pyrro…
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) | 2.03 | 10.33 | -17.82 | 1 | 7 | 0 | 85 | 376.464 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 10.47 | -40.1 | 2 | 7 | 1 | 86 | 377.472 | 4 | ↓ |