UCSF

ZINC01845277

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 11 Yes

Popular Name: 2-Azaspiro[4.5]decan-3-one 2-Azaspiro[4.5]decan-3-one

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CAS Numbers: 64744-50-9 , [64744-50-9]

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) 1.54 -1.76 -6.82 1 2 0 29 153.225 0 ↓

Vendor Notes

Note Type Comments Provided By
BP 181 / 13 TCI
MP 89 - 91 Enamine Building Blocks
MP 89...91 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks
MP 91 TCI
purity 95 Enamine Building Blocks
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific
Indications potential neuroprotector KeyOrganics Bioactives

Activity (Go SEA)

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