In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 22 | Yes |
Popular Name: 1-[4-[2-(4-methoxyphenyl)-2-oxo-ethyl]piperazin-1-yl]butan-1-one 1-[4-[2-(4-methoxyphenyl)-2-oxo-…
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) | 2.20 | 5.89 | -14.49 | 0 | 5 | 0 | 50 | 304.39 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.20 | 8.04 | -53.62 | 1 | 5 | 1 | 51 | 305.398 | 6 | ↓ |