COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL512686
Chemical Name: 8-[(1E)-3-(2-hydroxy-4,5-dimethylphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylicacid
Smiles: OC(=O)c1cc(/C=C/C(=O)c2cc(C)c(cc2O)C)c2c(c1)COCO2

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Molecular Weight: 354.36
Empirical Formula: C20H18O6

Physical State: Dry powder
Available Amount: 284 mg

Lipinsky:
logP: 3.948
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 93
Number of rings: 3

     

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