COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK788122
Chemical Name: (2E)-1-(3-hydroxyphenyl)-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)c2cccc(c2)O)cc2c1OCCO2

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Molecular Weight: 312.32
Empirical Formula: C18H16O5

Physical State: Dry powder
Available Amount: 84 mg

Lipinsky:
logP: 2.876
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 64
Number of rings: 3

     

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