UCSF

ZINC16696633

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2008 11 Yes

Popular Name: Endo-9-methyl-9-azabicyclo[3,3,1]nonan-3-amine Endo-9-methyl-9-azabicyclo[3,3,1…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 135906-03-5 , 141650-55-7 , 76272-41-8 , 76272-56-5 , [135906-03-5] , [76272-41-8] , [76272-56-5]

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) 0.49 3.16 -99.91 4 2 2 32 156.273 0 ↓
Hi High (pH 8-9.5) 0.49 2.84 -31.24 3 2 1 30 155.265 0 ↓
Mid Mid (pH 6-8) 0.49 1.17 -44.65 3 2 1 31 155.265 0 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific

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