| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 22 | No |
Popular Name: 5-(1-benzofuran-2-yl)-4-benzyl-4H-1,2,4-triazole-3-thiol 5-(1-benzofuran-2-yl)-4-benzyl-4…
| 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) | 4.33 | 11.36 | -46.01 | 0 | 4 | -1 | 44 | 306.37 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.61 | 11.25 | -9.2 | 1 | 4 | 0 | 47 | 307.378 | 3 | ↓ |
