UCSF

ZINC03888033

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 12 Yes

Popular Name: (2-Oxo-azepan-1-yl)-acetic acid (2-Oxo-azepan-1-yl)-acetic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 35048-56-7 , [35048-56-7]

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) -0.59 4.79 -53.84 0 4 -1 60 170.188 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 115 - 117 Enamine Building Blocks
MP 115...117 Enamine Building Blocks
MP 134 - 136 Enamine Building Blocks
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% )