COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL382085
Chemical Name: 4-hydroxy-3-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]-6-methyl-2H-pyran-2-one
Smiles: COc1cc(/C=C/C(=O)c2c(O)cc(oc2=O)C)ccc1O

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Molecular Weight: 302.28
Empirical Formula: C16H14O6

Physical State: Dry powder
Available Amount: 1003 mg

Lipinsky:
logP: 1.618
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 93
Number of rings: 2

     

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