UCSF

ZINC04740871

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 2nd, 2006 12 No

Popular Name: N-(5-Bromopyridin-2-yl)-2-chloroacetamide N-(5-Bromopyridin-2-yl)-2-chloro…

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CAS Numbers: 141454-61-7 , [141454-61-7]

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) 1.80 4.32 -13.57 1 3 0 42 249.495 2 ↓
Lo Low (pH 4.5-6) 1.80 4.07 -33.15 2 3 1 43 250.503 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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