| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2006 | 18 | No |
Popular Name: 4-[(3-bromophenyl)methyleneamino]-5-isopropyl-1,2,4-triazole-3-thiol 4-[(3-bromophenyl)methyleneamino…
| 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) | 2.81 | 8.85 | -7.83 | 1 | 4 | 0 | 46 | 325.235 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.54 | 9.48 | -47.87 | 0 | 4 | -1 | 43 | 324.227 | 3 | ↓ |
