COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK160059
Chemical Name: methyl(4Z)-2-methyl-1-(4-methylbenzyl)-4-(4-nitrobenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)[N+](=O)[O-])Cc1ccc(cc1)C

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Molecular Weight: 392.41
Empirical Formula: C22H20N2O5

Physical State: Dry powder
Available Amount: 143 mg

Lipinsky:
logP: 4.152
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 92
Number of rings: 3

     

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