In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 21 | No |
Popular Name: 5-bromo-4-[[(3S)-1,1-dioxothian-3-yl]sulfamoyl]furan-2-carboxylic 5-bromo-4-[[(3S)-1,1-dioxothian-…
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) | 0.49 | -0.24 | -59.82 | 1 | 8 | -1 | 134 | 401.236 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.49 | -0.42 | -96.71 | 0 | 8 | -2 | 136 | 400.228 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.