In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 18 | Yes |
Popular Name: 1-(3,4-dichlorophenyl)-2-(4-methylpiperazin-1-yl)ethanone 1-(3,4-dichlorophenyl)-2-(4-meth…
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) | 2.67 | 6.92 | -40.85 | 1 | 3 | 1 | 25 | 288.198 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.67 | 4.57 | -8.39 | 0 | 3 | 0 | 24 | 287.19 | 3 | ↓ |