In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 27 | Yes |
Popular Name: 2-[[(3R)-3-(benzofuran-2-yl)-3H-1,2,4-triazol-5-yl]sulfanyl]-N-(3,4-dichlorophenyl)acetamide 2-[[(3R)-3-(benzofuran-2-yl)-3H-…
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 | 9.16 | -14.95 | 2 | 6 | 0 | 84 | 419.293 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.96 | 8.96 | -50.14 | 1 | 6 | -1 | 82 | 418.285 | 5 | ↓ |