COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL475710
Chemical Name: 5,7-dimethoxy-4-methyl-6-[(2E)-3-methyl-6-oxo-6-(thiomorpholin-4-yl)hex-2-en-1-yl]-2-benzofuran-1(3H)-one
Smiles: COc1c(C/C=C(/CCC(=O)N2CCSCC2)\C)c(OC)c2c(c1C)COC2=O

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Molecular Weight: 419.54
Empirical Formula: C22H29NO5S

Available Amount: 0 mg

Lipinsky:
logP: 2.843
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 90
Number of rings: 3

     

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