| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 19 | No |
Popular Name: 1-[(3S)-1,1-dioxothian-3-yl]-4-fluoro-benzimidazole-2-thiol 1-[(3S)-1,1-dioxothian-3-yl]-4-f…
| 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) | 1.39 | 4.9 | -17.93 | 1 | 4 | 0 | 55 | 300.38 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.12 | 4.66 | -50.14 | 0 | 4 | -1 | 52 | 299.372 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
