COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK568577
Chemical Name: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1cccc(c1)OCCC(C)C

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Molecular Weight: 598.72
Empirical Formula: C34H34N2O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.376
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 126
Number of rings: 6

     

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