COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK700646
Chemical Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-bis(4-ethoxyphenyl)-6-methylpyridinium
Smiles: CCOc1ccc(cc1)c1cc(cc([n+]1CCc1ccc(c(c1)OC)OC)C)c1ccc(cc1)OCC

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Saltdata: ClO4-
Molecular Weight: 498.64
Empirical Formula: C32H36NO4

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 2.775
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 40
Number of rings: 4

     

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