| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 30 | No |
Popular Name: [(3S)-3-[4-(2-fluorophenyl)piperazin-1-yl]-1-piperidyl]-(4-nitrophenyl)methanone [(3S)-3-[4-(2-fluorophenyl)piper…
| 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) | 2.99 | 10.37 | -11.84 | 0 | 7 | 0 | 73 | 412.465 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.99 | 12.51 | -48.23 | 1 | 7 | 1 | 74 | 413.473 | 4 | ↓ |
