COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK093429
Chemical Name: 4-(benzylcarbamoyl)-1-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]pyridiniumbromide
Smiles: COc1ccc(cc1OC)C(=O)C[n+]1ccc(cc1)C(=O)NCc1ccccc1.[Br-]

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Molecular Weight: 471.35
Empirical Formula: C23H23BrN2O4

Physical State: Dry powder
Available Amount: 194 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 68
Number of rings: 3

     

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