In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 31 | Yes |
Popular Name: (4-allylpiperazin-1-yl)-[4-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]phenyl]methanone (4-allylpiperazin-1-yl)-[4-[[4-(…
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) | 2.95 | 9.39 | -9.26 | 0 | 5 | 0 | 30 | 422.548 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.95 | 11.6 | -45.55 | 1 | 5 | 1 | 31 | 423.556 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.95 | 13.83 | -91.63 | 2 | 5 | 2 | 32 | 424.564 | 6 | ↓ |