COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK192498
Chemical Name: 2-({2-bromo-6-chloro-4-[(Z)-2-cyano-2-(4-nitrophenyl)ethenyl]phenoxy}methyl)benzonitrile
Smiles: N#C/C(=C\c1cc(Cl)c(c(c1)Br)OCc1ccccc1C#N)/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 494.73
Empirical Formula: C23H13BrClN3O3

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 6.438
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 3

     

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