UCSF

ZINC00170627

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 23rd, 2005 17 No

Popular Name: 9-benzyl-9-azabicyclo[3.3.1]nonan-3-one 9-benzyl-9-azabicyclo[3.3.1]nona…

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CAS Numbers: 2291-58-9 , 2291-59-0 , 81879-64-3 , [2291-58-9]

Other Names:

MFCD00144851

ST-8741

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) 2.19 1.04 -43.19 1 2 1 22 230.331 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 66 - 68 Enamine Building Blocks
MP 66...68 Enamine Building Blocks
MP 69 - 71 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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

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