COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK159976
Chemical Name: ethyl(5E)-2-methyl-4-oxo-5-[4-(propan-2-yl)benzylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)C1=C(C)N/C(=C/c2ccc(cc2)C(C)C)/C1=O

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Molecular Weight: 299.37
Empirical Formula: C18H21NO3

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 3.165
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 55
Number of rings: 2

     

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