COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK693244
Chemical Name: (2E)-1-(1,3-benzodioxol-5-yl)-3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)c2ccc3c(c2)OCO3)c(c2c1OCO2)OC

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Molecular Weight: 356.33
Empirical Formula: C19H16O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.08
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 72
Number of rings: 4

     

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