UCSF

ZINC00163466

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2005 14 Yes

Popular Name: Bicyclo[2.2.2]octane-1,4-dicarboxylicacid Bicyclo[2.2.2]octane-1,4-dicarbo…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 711-02-4 , 711-04-0 , [711-02-4]

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) 0.29 4.79 -96.91 0 4 -2 80 196.202 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

Activity (Go SEA)

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