UCSF

ZINC56771611

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 8th, 2011 26 Yes

Popular Name: 1-methyl-3-[4-methyl-2-(2,2,2-trifluoroethoxy)phenyl]-1-[2-(2-pyridyl)ethyl]urea 1-methyl-3-[4-methyl-2-(2,2,2-tr…

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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) 3.68 8.73 -11.49 1 5 0 54 367.371 7 ↓
Lo Low (pH 4.5-6) 3.68 9.09 -35.37 2 5 1 56 368.379 7 ↓

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

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