COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL542561
Chemical Name: methyl3-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxo-4H-chromen-8-yl]-3-[4-(pyridin-2-ylmethoxy)phenyl]propanoate
Smiles: COC(=O)CC(c1c(O)cc(c2c1oc(c1ccc(c(c1)O)O)c(c2=O)O)O)c1ccc(cc1)OCc1ccccn1

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Molecular Weight: 571.54
Empirical Formula: C31H25NO10

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 3.696
Rotatable bonds: 12
H-donors: 5
H-acceptors: 10
PSA: 175
Number of rings: 5

     

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