COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK354713
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-1-(3,4-dichlorophenyl)prop-2-en-1-one
Smiles: O=C(c1ccc(c(c1)Cl)Cl)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 321.16
Empirical Formula: C16H10Cl2O3

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 5.57
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 35
Number of rings: 3

     

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