In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 22nd, 2010 | 21 | Yes |
Popular Name: (2S)-3-(4-acetylpiperazin-1-yl)-2-benzyl-3-oxo-propanenitrile (2S)-3-(4-acetylpiperazin-1-yl)-…
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) | 0.88 | 6.93 | -14 | 0 | 5 | 0 | 64 | 285.347 | 3 | ↓ |