| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 4th, 2010 | 17 | No |
Popular Name: 4-[(2R)-2-methylbutyl]-5-phenyl-1,2,4-triazole-3-thiol 4-[(2R)-2-methylbutyl]-5-phenyl-…
| 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) | 3.19 | 9.05 | -9.7 | 1 | 3 | 0 | 34 | 247.367 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.91 | 9.09 | -47.48 | 0 | 3 | -1 | 31 | 246.359 | 4 | ↓ |
