COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053002
Chemical Name: ethyl2-{(3E)-3-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(cc1)C(C)C

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Molecular Weight: 546.64
Empirical Formula: C30H30N2O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.729
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 134
Number of rings: 5

     

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