| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 20 | No |
Popular Name: 5-(4-pyridyl)-4-(1,1,3,3-tetramethylbutyl)-1,2,4-triazole-3-thiol 5-(4-pyridyl)-4-(1,1,3,3-tetrame…
| 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) | 3.78 | 7.16 | -44.45 | 0 | 4 | -1 | 44 | 289.428 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 6.67 | -8.15 | 1 | 4 | 0 | 47 | 290.436 | 4 | ↓ |
