COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK579830
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-hydroxyphenyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1cccc(c1)O

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Molecular Weight: 516.53
Empirical Formula: C27H20N2O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.564
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 146
Number of rings: 6

     

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