In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 13th, 2008 | 29 | No |
Popular Name: 4-chloro-3-[[4-(4,5-dihydro-3H-pyrrol-2-ylsulfamoyl)phenyl]sulfamoyl]benzoic 4-chloro-3-[[4-(4,5-dihydro-3H-p…
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) | 2.62 | 3.91 | -111.92 | 1 | 9 | -2 | 147 | 455.901 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.96 | 3.29 | -95.67 | 2 | 9 | -1 | 149 | 456.909 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 3.88 | -61.95 | 2 | 9 | -1 | 145 | 456.909 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.