In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2008 | 25 | Yes |
Popular Name: (4-cyclohexylpiperazin-1-yl)-[5-(3-pyridyl)-1H-pyrazol-3-yl]methanone (4-cyclohexylpiperazin-1-yl)-[5-…
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) | 2.40 | 7.92 | -44.56 | 2 | 6 | 1 | 66 | 340.451 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.40 | 8.07 | -89.25 | 3 | 6 | 2 | 68 | 341.459 | 3 | ↓ |