COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041562
Chemical Name: (4E)-5-(4-ethoxy-3-methoxyphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)OC)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)CC

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Molecular Weight: 544.63
Empirical Formula: C30H28N2O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.834
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 126
Number of rings: 5

     

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