In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2007 | 20 | Yes |
Popular Name: 5-bromo-N-(2-oxo-3H-benzooxazol-6-yl)-thiophene-2-sulfonamide 5-bromo-N-(2-oxo-3H-benzooxazol-…
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) | 2.80 | -6.9 | -11.84 | 2 | 6 | 0 | 92 | 375.225 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.80 | -6.32 | -33.66 | 1 | 6 | -1 | 94 | 374.217 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.26 | -0.99 | -96.75 | 0 | 6 | -2 | 97 | 373.209 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.