| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 29th, 2008 | 27 | Yes |
Popular Name: [4-[5-(4-chlorophenyl)-2H-pyrazol-3-yl]phenyl]-(4-methylpiperazin-1-yl)methanone [4-[5-(4-chlorophenyl)-2H-pyrazo…
| 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) | 3.20 | 10.31 | -49.48 | 2 | 5 | 1 | 53 | 381.887 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.20 | 7.97 | -10.49 | 1 | 5 | 0 | 52 | 380.879 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.20 | 10.32 | -46.92 | 2 | 5 | 1 | 53 | 381.887 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.20 | 7.97 | -11.29 | 1 | 5 | 0 | 52 | 380.879 | 3 | ↓ |
