UCSF

ZINC12506039

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 16 No

Popular Name: 3-Benzyl-3-azabicyclo[3.2.1]octan-8-one 3-Benzyl-3-azabicyclo[3.2.1]octa…

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CAS Numbers: 83507-33-9 , N/A

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) 1.92 8.5 -41.83 1 2 1 22 216.304 2 ↓
Hi High (pH 8-9.5) 1.92 6.86 -4.76 0 2 0 20 215.296 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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