In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 22 | Yes |
Popular Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-1-piperazin-1-yl-ethanone 2-[4-(4-fluorophenyl)piperazin-1…
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) | 0.74 | 4.54 | -51.55 | 2 | 5 | 1 | 43 | 307.393 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.74 | 2.08 | -9.72 | 1 | 5 | 0 | 39 | 306.385 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.74 | 5.68 | -108.92 | 3 | 5 | 2 | 45 | 308.401 | 3 | ↓ |