COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472685
Chemical Name: (2E)-3-[2-bromo-5-ethoxy-4-(propan-2-yloxy)phenyl]-2-cyano-N-(3-cyanothiophen-2-yl)prop-2-enamide
Smiles: CCOc1cc(/C=C(/C(=O)Nc2sccc2C#N)\C#N)c(cc1OC(C)C)Br

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Molecular Weight: 460.35
Empirical Formula: C20H18BrN3O3S

Physical State: Dry powder
Available Amount: 270 mg

Lipinsky:
logP: 5.697
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 123
Number of rings: 2

     

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