UCSF

ZINC13278357

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2008 29 Yes

Popular Name: 3-[[4-(2-pyridylsulfamoyl)phenyl]sulfamoyl]benzoic 3-[[4-(2-pyridylsulfamoyl)phenyl…

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Physical Representations

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) 2.63 4.69 -69.72 2 9 -1 149 432.459 6 ↓
Hi High (pH 8-9.5) 2.46 3.88 -168.5 0 9 -3 150 430.443 7 ↓
Hi High (pH 8-9.5) 2.46 3.83 -110.35 1 9 -2 147 431.451 7 ↓
Hi High (pH 8-9.5) 2.46 3.78 -98.56 1 9 -2 147 431.451 7 ↓
Lo Low (pH 4.5-6) 2.46 3.87 -78.76 3 9 0 147 433.467 7 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.