UCSF

ZINC40448801

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 10 Yes

Popular Name: Bicyclo[4.2.0]octa-1,3,5,7-tetraen-3-ylmethanol Bicyclo[4.2.0]octa-1,3,5,7-tetra…

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CAS Numbers: 53076-11-2 , [53076-11-2]

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) 1.87 3.23 -6.33 1 1 0 20 132.162 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 98% Fluorochem

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Rings

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

No pre-computed analogs available. Try a structural similarity search.