UCSF

ZINC19574064

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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-methylsulfanyl-benzyl)-amine (1-Aza-bicyclo[2.2.2]oct-3-yl)-(…

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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) 2.58 7.85 -35.28 2 2 1 16 263.43 4 ↓

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