UCSF

ZINC06657973

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2006 15 Yes

Popular Name: 7-(Trifluoromethyl)-3,4-dihydroquinoxalin-2(1H)-one 7-(Trifluoromethyl)-3,4-dihydroq…

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CAS Numbers: , 716-81-4 , [716-81-4]

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) 2.03 -0.62 -7.32 2 3 0 41 216.162 1 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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