COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL057235
Chemical Name: methyl2-{(3E)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-2-[3-(3-methylbutoxy)phenyl]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1cccc(c1)OCCC(C)C

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Molecular Weight: 578.64
Empirical Formula: C30H30N2O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.028
Rotatable bonds: 9
H-donors: 1
H-acceptors: 8
PSA: 152
Number of rings: 5

     

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