COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567788
Chemical Name: prop-2-en-1-yl2-[(3E)-3-{[4-(benzyloxy)-3-methylphenyl](hydroxy)methylidene}-2-(4-ethoxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCOC(=O)c1sc(nc1C)N1C(c2ccc(c(c2)OC)OCC)/C(=C(/c2ccc(c(c2)C)OCc2ccccc2)\O)/C(=O)C1=O

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Molecular Weight: 654.74
Empirical Formula: C36H34N2O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.572
Rotatable bonds: 12
H-donors: 1
H-acceptors: 8
PSA: 152
Number of rings: 5

     

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