UCSF

ZINC40448617

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 18 Yes

Popular Name: TERT-BUTYL 2,9-DIAZASPIRO[5.5]UNDECANE-2-CARBOXYLATE TERT-BUTYL 2,9-DIAZASPIRO[5.5]UN…

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CAS Numbers: 1023301-88-3 , 1023595-19-8 , 189333-03-7 , N/A , [1023301-88-3] , [189333-03-7]

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) 1.69 6.18 -38.25 2 4 1 46 255.382 2 ↓
Hi High (pH 8-9.5) 1.32 4.37 -97.02 9 9 2 152 474.491 5 ↓

Vendor Notes

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

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