| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2006 | 20 | Yes |
Popular Name: 1-(4-bromophenyl)-2-[(5-isobutyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone 1-(4-bromophenyl)-2-[(5-isobutyl…
| 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) | 3.67 | 8.75 | -15.31 | 1 | 4 | 0 | 59 | 354.273 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.67 | 8.58 | -40.39 | 0 | 4 | -1 | 57 | 353.265 | 6 | ↓ |
