In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 7th, 2006 | 29 | Yes |
Popular Name: 3-[[5-[(3,4-dimethoxyphenyl)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzoic 3-[[5-[(3,4-dimethoxyphenyl)meth…
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) | 3.95 | 1.89 | -62.01 | 0 | 7 | -1 | 89 | 412.491 | 9 | ↓ |