| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 18 | No |
Popular Name: 4-isobutyl-3-[2-(4-methylpyrazol-1-yl)ethyl]-1H-1,2,4-triazole-5-thione 4-isobutyl-3-[2-(4-methylpyrazol…
| 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) | 1.30 | 8.15 | -12.15 | 1 | 5 | 0 | 51 | 265.386 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.03 | 8.19 | -46 | 0 | 5 | -1 | 49 | 264.378 | 5 | ↓ |
