COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK377641
Chemical Name: (2Z)-3-{2-bromo-4-[(2,4-dichlorobenzyl)oxy]-5-methoxyphenyl}-2-(3-bromophenyl)prop-2-enenitrile
Smiles: COc1cc(/C=C(/c2cccc(c2)Br)\C#N)c(cc1OCc1ccc(cc1Cl)Cl)Br

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Molecular Weight: 568.09
Empirical Formula: C23H15Br2Cl2NO2

Physical State: Dry powder
Available Amount: 213 mg

Lipinsky:
logP: 9.154
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 42
Number of rings: 3

     

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