COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL471022
Chemical Name: (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-N-(pyridin-3-ylmethyl)hex-4-enamide
Smiles: COc1c(C/C=C(/CCC(=O)NCc2cccnc2)\C)c(O)c2c(c1C)COC2=O

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Molecular Weight: 410.47
Empirical Formula: C23H26N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.459
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 97
Number of rings: 3

     

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