UCSF

ZINC19092649

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2008 11 No

Popular Name: 1-Azepan-1-ylacetone hydrochloride 1-Azepan-1-ylacetone hydrochloride

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1158643-93-6 , 23982-56-1 , [1158643-93-6]

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) 1.30 5.72 -36.22 1 2 1 22 156.249 2 ↓

Vendor Notes

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

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