| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 13th, 2008 | 30 | No |
Popular Name: (E)-3-[4-[[4-(4,5-dihydro-3H-pyrrol-2-ylsulfamoyl)phenyl]sulfamoyl]phenyl]prop-2-enoic (E)-3-[4-[[4-(4,5-dihydro-3H-pyr…
| 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) | 2.07 | 4.5 | -58.83 | 2 | 9 | -1 | 145 | 448.502 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.42 | 3.85 | -94.53 | 2 | 9 | -1 | 149 | 448.502 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.07 | 4.64 | -103.35 | 1 | 9 | -2 | 147 | 447.494 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
