UCSF

ZINC19555885

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2008 18 Yes

Popular Name: (1-Aza-bicyclo[2.2.2]oct-3-yl)-(4-methoxy-benzyl)-amine (1-Aza-bicyclo[2.2.2]oct-3-yl)-(…

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CAS Numbers: 1185304-82-8 , 17186-53-7 , 774554-52-8

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) 2.21 6.05 -38.55 2 3 1 26 247.362 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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