COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK161460
Chemical Name: methyl(4Z)-1-(3,4-dimethoxyphenyl)-2-methyl-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-])c1ccc(c(c1)OC)OC

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Molecular Weight: 424.41
Empirical Formula: C22H20N2O7

Physical State: Dry powder
Available Amount: 113 mg

Lipinsky:
logP: 3.031
Rotatable bonds: 4
H-donors: 0
H-acceptors: 7
PSA: 110
Number of rings: 3

     

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