COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL363872
Chemical Name: methyl(4Z)-1-(4-ethoxyphenyl)-2-methyl-4-(3-nitrobenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOc1ccc(cc1)N1C(=O)/C(=C\c2cccc(c2)[N+](=O)[O-])/C(=C1C)C(=O)OC

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Molecular Weight: 408.41
Empirical Formula: C22H20N2O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.862
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 101
Number of rings: 3

     

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