COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL177359
Chemical Name: (2E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(5-methylthiophen-2-yl)prop-2-en-1-one
Smiles: Cc1ccc(s1)/C=C/C(=O)c1ccc2c(c1)OCCO2

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Molecular Weight: 286.35
Empirical Formula: C16H14O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.455
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 63
Number of rings: 3

     

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