| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2008 | 21 | No |
Popular Name: 4-(4-tert-butylphenyl)-5-(2-thienyl)-1,2,4-triazole-3-thiol 4-(4-tert-butylphenyl)-5-(2-thie…
| 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) | 5.05 | 11.59 | -50.39 | 0 | 3 | -1 | 31 | 314.459 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.33 | 11.74 | -13.04 | 1 | 3 | 0 | 34 | 315.467 | 3 | ↓ |
