| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2004 | 26 | Yes |
Popular Name: N-(1,3-benzodioxol-5-yl)-2-[[3-(2-bromophenyl)-1H-1,2,4-triazol-5-yl]thio]acetamide N-(1,3-benzodioxol-5-yl)-2-[[3-(…
| 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) | 3.88 | 7.25 | -17.3 | 2 | 7 | 0 | 89 | 433.287 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.88 | 7.26 | -48.61 | 1 | 7 | -1 | 87 | 432.279 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.07 | 4.94 | -45.69 | 1 | 7 | -1 | 91 | 432.279 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.07 | 5.32 | -13.59 | 2 | 7 | 0 | 93 | 433.287 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.88 | 7.43 | -19.66 | 2 | 7 | 0 | 89 | 433.287 | 5 | ↓ |
