In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 1st, 2009 | 22 | Yes |
Popular Name: [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-(1-methylpyrazol-4-yl)methanone [4-[(2-fluorophenyl)methyl]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) | 0.69 | 5.39 | -10.84 | 0 | 5 | 0 | 41 | 302.353 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.69 | 7.6 | -44.09 | 1 | 5 | 1 | 43 | 303.361 | 3 | ↓ |