In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2008 | 20 | Yes |
Popular Name: 1-(4-fluorophenyl)-4-(1-methyl-4-piperidyl)piperazine 1-(4-fluorophenyl)-4-(1-methyl-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) | 2.52 | 6.07 | -41.38 | 1 | 3 | 1 | 11 | 278.395 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.52 | 6.21 | -38.2 | 1 | 3 | 1 | 11 | 278.395 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.52 | 9.64 | -109.36 | 2 | 3 | 2 | 12 | 279.403 | 2 | ↓ |