In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2006 | 25 | Yes |
Popular Name: 2-[[5-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]-N,N-diisobutyl-acetamide 2-[[5-(2-fluorophenyl)-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) | 4.14 | 10.65 | -12.6 | 1 | 5 | 0 | 62 | 364.49 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.14 | 10.41 | -51.39 | 0 | 5 | -1 | 60 | 363.482 | 8 | ↓ |