COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK293159
Chemical Name: 4-[(Z)-2-(6-bromo-1,3-benzodioxol-5-yl)-1-cyanoethenyl]benzonitrile
Smiles: N#C/C(=C\c1cc2OCOc2cc1Br)/c1ccc(cc1)C#N

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Molecular Weight: 353.17
Empirical Formula: C17H9BrN2O2

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 5.077
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 66
Number of rings: 3

     

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