In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 27 | Yes |
Popular Name: 2-[[4-benzyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-methyl-acetamide 2-[[4-benzyl-5-(2-thienyl)-1,2,4…
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) | 2.68 | 12.11 | -17.29 | 0 | 6 | 0 | 75 | 397.529 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.