| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 7th, 2010 | 25 | No |
Popular Name: (3R)-3-(benzofuran-2-yl)-5-[(4-nitrophenyl)methylsulfanyl]-3H-1,2,4-triazole (3R)-3-(benzofuran-2-yl)-5-[(4-n…
| 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) | 4.43 | 10.63 | -13.72 | 1 | 7 | 0 | 101 | 352.375 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.43 | 10.42 | -45.56 | 0 | 7 | -1 | 99 | 351.367 | 5 | ↓ |
