| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 6th, 2010 | 18 | Yes |
Popular Name: (3S)-3-(benzofuran-2-yl)-5-prop-2-ynylsulfanyl-3H-1,2,4-triazole (3S)-3-(benzofuran-2-yl)-5-prop-…
| 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) | 3.03 | 7.41 | -9.84 | 1 | 4 | 0 | 55 | 255.302 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.03 | 7.21 | -47.31 | 0 | 4 | -1 | 53 | 254.294 | 3 | ↓ |
