| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 23rd, 2010 | 22 | Yes |
Popular Name: (4-isopropylpiperazin-1-yl)-(5-phenyl-1H-pyrazol-3-yl)methanone (4-isopropylpiperazin-1-yl)-(5-p…
| 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) | 2.23 | 5.7 | -8.27 | 1 | 5 | 0 | 52 | 298.39 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.23 | 7.83 | -44.65 | 2 | 5 | 1 | 53 | 299.398 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.23 | 7.98 | -38.89 | 2 | 5 | 1 | 53 | 299.398 | 3 | ↓ |
