UCSF

ZINC13322879

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 17th, 2008 14 No

Popular Name: 3-chloro-N-(3-fluoro-4-methylphenyl)propanamide 3-chloro-N-(3-fluoro-4-methylphe…

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CAS Numbers: 908494-81-5 , [908494-81-5]

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) 2.53 5.54 -9.9 1 2 0 29 215.655 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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