In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 24th, 2007 | 30 | Yes |
Popular Name: 3-[[5-benzyl-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]azepan-2-one 3-[[5-benzyl-4-(4-ethoxyphenyl)-…
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) | 4.15 | -0.64 | -15.9 | 1 | 6 | 0 | 69 | 422.554 | 7 | ↓ |