UCSF

ZINC45028307

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2010 8 Yes

Popular Name: 2-Oxa-6-azaspiro[3.4]octane 2-Oxa-6-azaspiro[3.4]octane

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1408075-00-2 , 220290-68-6 , [220290-68-6]

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) 0.15 0.71 -39.28 2 2 1 26 114.168 0 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 187? Alfa-Aesar
BP 187° Matrix Scientific
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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