| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 8th, 2009 | 25 | Yes |
Popular Name: 1-(1,3-benzodioxol-5-yl)-2-[[5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]ethanone 1-(1,3-benzodioxol-5-yl)-2-[[5-(…
| 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) | 4.14 | 8.58 | -20.89 | 1 | 6 | 0 | 77 | 373.821 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.14 | 8.41 | -41.36 | 0 | 6 | -1 | 75 | 372.813 | 5 | ↓ |
