In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2008 | 30 | Yes |
Popular Name: 2-[[4-benzyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dimethylphenyl)ethanone 2-[[4-benzyl-5-(4-pyridyl)-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) | 4.77 | 14.11 | -11.91 | 0 | 5 | 0 | 61 | 414.534 | 7 | ↓ |