UCSF

ZINC85346893

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2013 10 Yes

Popular Name: 2-(2,2,2-Trifluoro-1-methyl-ethoxy)-ethylamine 2-(2,2,2-Trifluoro-1-methyl-etho…

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Download: MOL2 SDF SMILES Flexibase

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) 0.39 0.78 -41.7 3 2 1 37 158.143 4 ↓
Hi High (pH 8-9.5) 0.39 0.32 -4.67 2 2 0 35 157.135 4 ↓

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

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