| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 28th, 2008 | 23 | No |
Popular Name: (E)-3-[4-(1-piperidyl)phenyl]-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile (E)-3-[4-(1-piperidyl)phenyl]-2-…
| 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) | 3.15 | 9.21 | -7.88 | 0 | 4 | 0 | 47 | 309.413 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 9.85 | -36.94 | 1 | 4 | 1 | 49 | 310.421 | 3 | ↓ |
