| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2011 | 21 | Yes |
Popular Name: (2S)-N-(4-cyanophenyl)-2-(3,3-dimethyl-1-piperidyl)propanamide (2S)-N-(4-cyanophenyl)-2-(3,3-di…
| 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) | 2.79 | 8.68 | -43.42 | 2 | 4 | 1 | 57 | 286.399 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.98 | 7.01 | -26.67 | 1 | 4 | 0 | 64 | 285.391 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.98 | 5.2 | -37.41 | 0 | 4 | -1 | 62 | 284.383 | 3 | ↓ |
