UCSF

ZINC03226867

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 14 Yes

Popular Name: 2-cyano-N-(3,4-dimethylphenyl)acetamide 2-cyano-N-(3,4-dimethylphenyl)ac…

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CAS Numbers: 24522-42-7 , [24522-42-7]

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) 1.40 5.09 -17.5 1 3 0 53 188.23 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 63 - 65 Enamine Building Blocks
MP 63...65 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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