COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL542441
Chemical Name: methyl3-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-3-[4-(octyloxy)phenyl]propanoate
Smiles: CCCCCCCCOc1ccc(cc1)C(c1c(O)ccc2c1occ(c2=O)c1ccc(cc1)O)CC(=O)OC

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Molecular Weight: 544.64
Empirical Formula: C33H36O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.958
Rotatable bonds: 13
H-donors: 2
H-acceptors: 7
PSA: 102
Number of rings: 4

     

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