In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2006 | 28 | Yes |
Popular Name: N-(2,5-dimethoxyphenyl)-2-[[5-(4-ethylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(2,5-dimethoxyphenyl)-2-[[5-(4…
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) | 4.18 | 7.91 | -13.46 | 2 | 7 | 0 | 89 | 398.488 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.18 | 7.71 | -51.73 | 1 | 7 | -1 | 87 | 397.48 | 8 | ↓ |