In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2009 | 20 | Yes |
Popular Name: N-(4-bromo-2-fluoro-phenyl)-2-[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(4-bromo-2-fluoro-phenyl)-2-[(…
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) | 2.67 | 6.11 | -16.27 | 2 | 5 | 0 | 71 | 359.224 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.67 | 5.96 | -40.39 | 1 | 5 | -1 | 69 | 358.216 | 5 | ↓ |