COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL247673
Chemical Name: methyl3-[(3E)-3-(4-hydroxy-3-methoxybenzylidene)-2,5-dioxopyrrolidin-1-yl]thiophene-2-carboxylate
Smiles: COC(=O)c1sccc1N1C(=O)C/C(=C\c2ccc(c(c2)OC)O)/C1=O

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Molecular Weight: 373.39
Empirical Formula: C18H15NO6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.741
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 121
Number of rings: 3

     

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