In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2006 | 25 | Yes |
Popular Name: N-(3,4-dichlorophenyl)-2-[[5-(p-tolyl)-4H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(3,4-dichlorophenyl)-2-[[5-(p-…
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) | 4.96 | 9.43 | -13.39 | 2 | 5 | 0 | 71 | 393.299 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.96 | 9.23 | -47.78 | 1 | 5 | -1 | 69 | 392.291 | 5 | ↓ |