UCSF

ZINC01386068

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 25 Yes

Popular Name: 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)-2-quinoxalinyl]acetamide 2-(4-chlorophenyl)-2-[3-(trifluo…

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CAS Number: 338412-17-2

Other Names:

MFCD00793792

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) 4.08 -0.79 -12.49 2 4 0 68 365.742 4 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 192 - 194 KeyOrganics

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Rings

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

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