| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 19 | Yes |
Popular Name: [5-(4-tert-butylpiperazin-1-yl)-1,3-dimethyl-pyrazol-4-yl]methanol [5-(4-tert-butylpiperazin-1-yl)-…
| 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) | 1.18 | 4.76 | -40.48 | 2 | 5 | 1 | 46 | 267.397 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.18 | 2.69 | -6.47 | 1 | 5 | 0 | 45 | 266.389 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 4.89 | -81.81 | 3 | 5 | 2 | 47 | 268.405 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
