In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 25th, 2011 | 21 | Yes |
Popular Name: 1-(4-acetylpiperazin-1-yl)-2-[4-(methylaminomethyl)-1-piperidyl]ethanone 1-(4-acetylpiperazin-1-yl)-2-[4-…
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) | -0.50 | 5.77 | -108.02 | 3 | 6 | 2 | 62 | 298.431 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.50 | 3.59 | -48.91 | 2 | 6 | 1 | 60 | 297.423 | 4 | ↓ |