In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2011 | 27 | No |
Popular Name: N-[4-(difluoromethylsulfanyl)phenyl]-2-[3-(p-tolyl)-5-sulfanyl-1,2,4-triazol-4-yl]acetamide N-[4-(difluoromethylsulfanyl)phe…
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) | 3.80 | 10.86 | -21.03 | 2 | 5 | 0 | 63 | 406.483 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.53 | 10.96 | -61.96 | 1 | 5 | -1 | 60 | 405.475 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.