COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK159921
Chemical Name: methyl(4Z)-4-[4-(methoxycarbonyl)benzylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\C(=O)NC(=C1C(=O)OC)C

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Molecular Weight: 301.3
Empirical Formula: C16H15NO5

Physical State: Dry powder
Available Amount: 177 mg

Lipinsky:
logP: 1.686
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 81
Number of rings: 2

     

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