COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK629984
Chemical Name: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(5-methylfuran-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C\1/C(c2ccc(o2)C)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)/O

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Molecular Weight: 474.54
Empirical Formula: C26H22N2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.187
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 121
Number of rings: 5

     

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