In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2008 | 25 | Yes |
Popular Name: 2-[[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethylphenyl)acetamide 2-[[5-(2-chlorophenyl)-4H-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 | 9.84 | -20.76 | 2 | 5 | 0 | 71 | 372.881 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.77 | 9.68 | -48.03 | 1 | 5 | -1 | 69 | 371.873 | 6 | ↓ |