| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2004 | 28 | Yes |
Popular Name: 1-(3,4-dimethoxyphenyl)-2-[[3-[(4-methylphenoxy)methyl]-1H-1,2,4-triazol-5-yl]thio]ethanone 1-(3,4-dimethoxyphenyl)-2-[[3-[(…
| 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) | 3.31 | 8.87 | -21.06 | 1 | 7 | 0 | 86 | 399.472 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.31 | 8.71 | -47.59 | 0 | 7 | -1 | 85 | 398.464 | 9 | ↓ |
