COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149749
Chemical Name: prop-2-en-1-yl2-[(3E)-3-{[4-(benzyloxy)-2-methylphenyl](hydroxy)methylidene}-2-(3-ethoxy-4-hydroxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2C)OCc2ccccc2)/O)/C1c1ccc(c(c1)OCC)O

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Molecular Weight: 640.71
Empirical Formula: C35H32N2O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.804
Rotatable bonds: 12
H-donors: 2
H-acceptors: 8
PSA: 163
Number of rings: 5

     

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