COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL542349
Chemical Name: methyl3-(3,5-di-tert-butyl-4-hydroxyphenyl)-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate
Smiles: COC(=O)CC(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

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Molecular Weight: 560.64
Empirical Formula: C33H36O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.495
Rotatable bonds: 8
H-donors: 4
H-acceptors: 8
PSA: 133
Number of rings: 4

     

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