UCSF

ZINC72194362

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2012 16 Yes

Popular Name: TERT-BUTYL 1,7-DIAZASPIRO[3.5]NONANE-1-CARBOXYLATE TERT-BUTYL 1,7-DIAZASPIRO[3.5]NO…

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CAS Numbers: 1216936-29-6 , [121693-62-7] , [1216936-29-6]

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) 1.40 4.14 -36.39 2 4 1 46 227.328 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 94% Matrix Scientific
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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

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