UCSF

ZINC40443003

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 8 Yes

Popular Name: 4-Oxa-7-azaspiro[2.5]octane 4-Oxa-7-azaspiro[2.5]octane

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1427195-23-0 , 220291-92-9 , [220291-92-9]

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) 0.03 1.43 -39.59 2 2 1 26 114.168 0 ↓
Hi High (pH 8-9.5) 0.03 0.1 -2.83 1 2 0 21 113.16 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

Rings

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

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