UCSF

ZINC19515713

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 14 Yes

Popular Name: 2-Cyano-N-(2,5-difluorophenyl)acetamide 2-Cyano-N-(2,5-difluorophenyl)ac…

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CAS Number: 87165-17-1

Other Names:

MFCD09948941

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) 0.83 4.04 -18.62 1 3 0 53 196.156 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4393217 IBM Patent Data

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