UCSF

ZINC02169127

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 14 No

Popular Name: 7-amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 7-amino-3-methyl-8-oxo-5-thia-1-…

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CAS Numbers: 22252-43-3 , 26395-99-3 , 26395-99-3 ; 22252-43-3 , [22252-43-3] , [24701-69-1]

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) -0.83 1.1 -83.03 3 5 0 88 214.246 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 98% Fluorochem
Melting_Point ca 234? dec. Alfa-Aesar
Melting_Point ca 234° dec. Alfa-Aesar
Warnings IRRITANT Matrix Scientific
Purity ¡Ý98% APIChem

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