COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK575129
Chemical Name: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxy-4-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C

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Molecular Weight: 578.64
Empirical Formula: C30H30N2O8S

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 4.971
Rotatable bonds: 9
H-donors: 1
H-acceptors: 8
PSA: 152
Number of rings: 5

     

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