UCSF

ZINC02559562

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 14 No

Popular Name: 2,2,2-Trifluoro-1-(2-hydroxy-5-methylphenyl)-ethanone 2,2,2-Trifluoro-1-(2-hydroxy-5-m…

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CAS Number: 70978-57-3

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) 2.75 2.56 -5.7 1 2 0 37 204.147 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 41° Fluorochem

Activity (Go SEA)

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