| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2010 | 20 | Yes |
Popular Name: 2-[[4-[4-(cyanomethyl)phenyl]-5-methyl-1,2,4-triazol-3-yl]sulfanyl]acetic 2-[[4-[4-(cyanomethyl)phenyl]-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) | 0.95 | 9.97 | -53.21 | 0 | 6 | -1 | 95 | 287.324 | 5 | ↓ |
