In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 23 | Yes |
Popular Name: 1-[4-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]piperazin-1-yl]propan-1-one 1-[4-[2-(3,4-dimethoxyphenyl)-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) | 1.23 | 5.03 | -17.98 | 0 | 6 | 0 | 59 | 320.389 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.23 | 7.18 | -59.03 | 1 | 6 | 1 | 60 | 321.397 | 6 | ↓ |