| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 7th, 2006 | 22 | Yes |
Popular Name: N-(2-cyanoethyl)-2-[[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(2-cyanoethyl)-2-[[5-(4-methox…
| 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) | 1.05 | 4.68 | -18.79 | 2 | 7 | 0 | 104 | 317.374 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 4.48 | -51.32 | 1 | 7 | -1 | 102 | 316.366 | 7 | ↓ |
