COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK165343
Chemical Name: methyl(4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-4-[4-(methylsulfanyl)benzylidene]-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CSc1ccc(cc1)/C=C/1\C(=O)N(C(=C1C(=O)OC)C)CCc1ccc(c(c1)OC)OC

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Molecular Weight: 453.56
Empirical Formula: C25H27NO5S

Physical State: Dry powder
Available Amount: 147 mg

Lipinsky:
logP: 4.474
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 90
Number of rings: 3

     

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