COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK116971
Chemical Name: (2Z)-2-(3-bromophenyl)-3-(6-ethoxy-1,3-benzodioxol-5-yl)prop-2-enenitrile
Smiles: CCOc1cc2OCOc2cc1/C=C(/c1cccc(c1)Br)\C#N

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Molecular Weight: 372.22
Empirical Formula: C18H14BrNO3

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 5.974
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 3

     

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