In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2004 | 23 | Yes |
Popular Name: N-(2-cyanoethyl)-2-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-methyl-acetamide N-(2-cyanoethyl)-2-[[4-(2-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) | 0.68 | 9.39 | -18.16 | 0 | 7 | 0 | 84 | 331.401 | 7 | ↓ |