UCSF

ZINC08390468

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2006 12 No

Popular Name: 1-(2-chloropropanoyl)azepane 1-(2-chloropropanoyl)azepane

Find On: PubMed — Wikipedia — Google

CAS Numbers: 115840-34-1 , [115840-34-1]

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) 2.05 5.92 -6.56 0 2 0 20 189.686 1 ↓

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% )