| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 13th, 2008 | 30 | Yes |
Popular Name: 4-methyl-3-[[4-(2-pyridylsulfamoyl)phenyl]sulfamoyl]benzoic 4-methyl-3-[[4-(2-pyridylsulfamo…
| 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) | 3.03 | 5.08 | -71.82 | 2 | 9 | -1 | 149 | 446.486 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.86 | 4.67 | -182.45 | 0 | 9 | -3 | 150 | 444.47 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.86 | 4.57 | -116.32 | 1 | 9 | -2 | 147 | 445.478 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.86 | 4.61 | -116.82 | 1 | 9 | -2 | 147 | 445.478 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.86 | 4.66 | -77.11 | 3 | 9 | 0 | 147 | 447.494 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
