| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 21 | Yes |
Popular Name: 1-[2-[(3-cyanophenyl)amino]-2-oxo-ethyl]piperidine-4-carboxamide 1-[2-[(3-cyanophenyl)amino]-2-ox…
| 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) | 0.75 | 3.84 | -62.71 | 4 | 6 | 1 | 100 | 287.343 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.75 | 1.64 | -26.9 | 3 | 6 | 0 | 99 | 286.335 | 4 | ↓ |
