UCSF

ZINC48452970

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2010 20 Yes

Popular Name: 1-(2-bromo-4-fluoro-phenyl)-3-[2-(2-pyridyl)ethyl]urea 1-(2-bromo-4-fluoro-phenyl)-3-[2…

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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) 2.98 5.72 -9.88 2 4 0 54 338.18 4 ↓
Lo Low (pH 4.5-6) 2.98 6.07 -37.88 3 4 1 55 339.188 4 ↓

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

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