COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL419986
Chemical Name: (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoicacid
Smiles: COc1c(C/C=C(/CCC(=O)O)\C)c(O)c2c(c1C)COC2=O

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Molecular Weight: 320.34
Empirical Formula: C17H20O6

Physical State: Dry powder
Available Amount: 1005 mg

Lipinsky:
logP: 2.924
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 93
Number of rings: 2

     

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