COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK179179
Chemical Name: (2E)-3-{3-bromo-4-[(2-cyanobenzyl)oxy]phenyl}-2-cyano-N-(2,3-dichlorophenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(c(c1)Br)OCc1ccccc1C#N)/C(=O)Nc1cccc(c1Cl)Cl

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Molecular Weight: 527.2
Empirical Formula: C24H14BrCl2N3O2

Physical State: Dry powder
Available Amount: 168 mg

Lipinsky:
logP: 6.347
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 85
Number of rings: 3

     

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