COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK387620
Chemical Name: (2E)-3-{2-bromo-4-[(2,4-dichlorobenzyl)oxy]-5-methoxyphenyl}-2-cyano-N-(3,4-dimethylphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(OC)c(cc1Br)OCc1ccc(cc1Cl)Cl)/C(=O)Nc1ccc(c(c1)C)C

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Molecular Weight: 560.27
Empirical Formula: C26H21BrCl2N2O3

Physical State: Dry powder
Available Amount: 214 mg

Lipinsky:
logP: 8.141
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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