COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK118377
Chemical Name: (2E)-3-{3-bromo-4-[(2,4-dichlorobenzyl)oxy]phenyl}-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1ccc(c(c1)Br)OCc1ccc(cc1Cl)Cl)/C(=O)N

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Molecular Weight: 426.1
Empirical Formula: C17H11BrCl2N2O2

Physical State: Dry powder
Available Amount: 1230 mg

Lipinsky:
logP: 4.441
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 76
Number of rings: 2

     

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