| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 22 | Yes |
Popular Name: (2S)-N-(2-cyanoethyl)-N-methyl-2-[4-(2-pyridyl)piperazin-1-yl]propanamide (2S)-N-(2-cyanoethyl)-N-methyl-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) | 0.17 | 6.25 | -36.97 | 1 | 6 | 1 | 65 | 302.402 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.17 | 5.93 | -14.28 | 0 | 6 | 0 | 63 | 301.394 | 5 | ↓ |
