COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL471196
Chemical Name: (4E)-N-(1,3-benzodioxol-5-ylmethyl)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enamide
Smiles: COc1c(C/C=C(/CCC(=O)NCc2ccc3c(c2)OCO3)\C)c(O)c2c(c1C)COC2=O

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Molecular Weight: 453.49
Empirical Formula: C25H27NO7

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 3.813
Rotatable bonds: 9
H-donors: 2
H-acceptors: 7
PSA: 103
Number of rings: 4

     

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