COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK101774
Chemical Name: methyl(5E)-5-(2,6-dimethoxybenzylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: COC(=O)C1=C(C)N/C(=C/c2c(OC)cccc2OC)/C1=O

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Molecular Weight: 303.31
Empirical Formula: C16H17NO5

Physical State: Dry powder
Available Amount: 286 mg

Lipinsky:
logP: 1.186
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 73
Number of rings: 2

     

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