COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL435085
Chemical Name: (2E)-3-(2-chloro-3,4,5-trimethoxyphenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)c2ccc3c(c2)OCCO3)c(c(c1OC)OC)Cl

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Molecular Weight: 390.82
Empirical Formula: C20H19ClO6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.42
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 63
Number of rings: 3

     

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