| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2010 | 20 | Yes |
Popular Name: N-[3-(cyanomethoxy)phenyl]-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide N-[3-(cyanomethoxy)phenyl]-2-(4H…
| 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) | 0.93 | 4.86 | -15.76 | 2 | 7 | 0 | 104 | 289.32 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.93 | 4.66 | -46.64 | 1 | 7 | -1 | 102 | 288.312 | 6 | ↓ |
