In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 18 | Yes |
Popular Name: 2-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)ethanone 2-(4-ethylpiperazin-1-yl)-1-(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) | 1.90 | 6.7 | -39.22 | 1 | 3 | 1 | 25 | 251.325 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.90 | 4.42 | -9.18 | 0 | 3 | 0 | 24 | 250.317 | 4 | ↓ |