In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 18 | Yes |
Popular Name: 1-(4-ethylpiperazin-1-yl)-2-(3-fluorophenyl)ethanone 1-(4-ethylpiperazin-1-yl)-2-(3-f…
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) | 1.88 | 8.01 | -46.58 | 1 | 3 | 1 | 25 | 251.325 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 5.8 | -9.7 | 0 | 3 | 0 | 24 | 250.317 | 3 | ↓ |