COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056572
Chemical Name: methyl2-{(3E)-2-(4-hydroxy-3-methoxyphenyl)-3-[hydroxy(3-methoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COc1cccc(c1)/C(=C\1/C(c2ccc(c(c2)OC)O)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)/O

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Molecular Weight: 510.52
Empirical Formula: C25H22N2O8S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 3.359
Rotatable bonds: 8
H-donors: 2
H-acceptors: 8
PSA: 163
Number of rings: 4

     

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