COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK160011
Chemical Name: methyl(5E)-5-[2-(benzyloxy)benzylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: COC(=O)C1=C(C)N/C(=C/c2ccccc2OCc2ccccc2)/C1=O

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Molecular Weight: 349.39
Empirical Formula: C21H19NO4

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 2.955
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 3

     

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