| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 16 | No |
Popular Name: 4-[(E)-(2-bromo-5-hydroxy-benzylidene)amino]-1H-1,2,4-triazole-5-thione 4-[(E)-(2-bromo-5-hydroxy-benzyl…
| 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) | 1.14 | 5.36 | -19.58 | 2 | 5 | 0 | 66 | 299.153 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 6.2 | -89.1 | 0 | 5 | -2 | 66 | 297.137 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.87 | 5.44 | -51.6 | 1 | 5 | -1 | 63 | 298.145 | 2 | ↓ |
