| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 21 | No |
Popular Name: (E)-3-[5-(4-isopropylpiperazin-1-yl)-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic (E)-3-[5-(4-isopropylpiperazin-1…
| 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) | 1.12 | 7.63 | -65.73 | 1 | 6 | 0 | 66 | 292.383 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 5.47 | -56 | 0 | 6 | -1 | 64 | 291.375 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 7.74 | -91.19 | 2 | 6 | 1 | 67 | 293.391 | 4 | ↓ |
