COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048500
Chemical Name: methyl2-{(3E)-2-[3-ethoxy-4-(3-methylbutoxy)phenyl]-3-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC

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Molecular Weight: 620.72
Empirical Formula: C33H36N2O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.069
Rotatable bonds: 11
H-donors: 1
H-acceptors: 8
PSA: 152
Number of rings: 5

     

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