UCSF

ZINC66323541

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2011 12 Yes

Popular Name: 1-Oxa-9-azaspiro[5.5]undecan-4-ol hydrochloride 1-Oxa-9-azaspiro[5.5]undecan-4-o…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1306739-26-3 , 1332529-93-7 , 399033-70-6

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) -0.05 -0.14 -40.78 3 3 1 46 172.248 0 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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Rings

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

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