| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 19 | No |
Popular Name: 4-[(E)-(2-bromo-5-hydroxy-benzylidene)amino]-5-(difluoromethyl)-1,2,4-triazole-3-thiolate 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) | 2.51 | 6.03 | -48.28 | 1 | 5 | -1 | 63 | 348.152 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.51 | 6.79 | -89.37 | 0 | 5 | -2 | 66 | 347.144 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.78 | 5.06 | -9.72 | 2 | 5 | 0 | 66 | 349.16 | 3 | ↓ |
