COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK377626
Chemical Name: (2E)-3-{3-bromo-4-[(2-cyanobenzyl)oxy]phenyl}-2-cyano-N-(4-methoxyphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(c(c1)Br)OCc1ccccc1C#N)/C(=O)Nc1ccc(cc1)OC

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Molecular Weight: 488.34
Empirical Formula: C25H18BrN3O3

Physical State: Dry powder
Available Amount: 276 mg

Lipinsky:
logP: 5.004
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 95
Number of rings: 3

     

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