UCSF

ZINC01382204

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 23 Yes

Popular Name: 1-methyl-3-[3-(trifluoromethyl)phenoxy]-2(1H)-quinoxalinone 1-methyl-3-[3-(trifluoromethyl)p…

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CAS Number: 338774-65-5

Other Names:

MFCD00244520

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) 4.00 2.4 -12.01 0 4 0 44 320.27 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 158 - 161 KeyOrganics

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Rings

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

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