UCSF

ZINC04028352

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2005 10 Yes

Popular Name: azepane-2-carboxylic acid azepane-2-carboxylic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 5227-52-1 , 5227-53-2 , [5227-53-2]

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) -0.71 2.87 -37.42 2 3 0 57 143.186 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 211 - 213 Enamine Building Blocks
MP 211...213 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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