COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK362246
Chemical Name: ethyl(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)C1=C(C)N/C(=C/c2ccc3c(c2)OCO3)/C1=O

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Molecular Weight: 301.3
Empirical Formula: C16H15NO5

Physical State: Dry powder
Available Amount: 44 mg

Lipinsky:
logP: 1.947
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 73
Number of rings: 3

     

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