In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2008 | 28 | Yes |
Popular Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[5-(4-fluorophenyl)-2H-pyrazol-3-yl]methanone [4-(2,3-dimethylphenyl)piperazin…
None
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) | 4.22 | 11 | -8.47 | 1 | 5 | 0 | 52 | 378.451 | 3 | ↓ |
Ref Reference (pH 7) | 4.22 | 11.15 | -9.32 | 1 | 5 | 0 | 52 | 378.451 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.22 | 11.09 | -38.67 | 2 | 5 | 1 | 53 | 379.459 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.22 | 10.86 | -44.15 | 2 | 5 | 1 | 53 | 379.459 | 3 | ↓ |