In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 25th, 2010 | 31 | Yes |
Popular Name: 1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-2-(6-methyl-3-pyridyl)ethanone 1-[4-[bis(4-fluorophenyl)methyl]…
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) | 3.68 | 11.85 | -14.48 | 0 | 4 | 0 | 36 | 421.491 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.68 | 13.43 | -60.87 | 1 | 4 | 1 | 38 | 422.499 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.68 | 13.87 | -100.73 | 2 | 4 | 2 | 39 | 423.507 | 5 | ↓ |