In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2006 | 22 | Yes |
Popular Name: N-(2-bromo-4-methyl-phenyl)-2,5-dioxabicyclo[4.4.0]deca-7,9,11-triene-8-sulfonamide N-(2-bromo-4-methyl-phenyl)-2,5-…
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) | 3.40 | -4.35 | -9.65 | 1 | 5 | 0 | 64 | 384.251 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.40 | -3.84 | -42.34 | 0 | 5 | -1 | 66 | 383.243 | 3 | ↓ |