COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382429
Chemical Name: ethyl(2-bromo-4-{(1E)-2-cyano-3-[(2-methylcyclohexyl)amino]-3-oxoprop-1-en-1-yl}-6-methoxyphenoxy)acetate
Smiles: CCOC(=O)COc1c(Br)cc(cc1OC)/C=C(/C(=O)NC1CCCCC1C)\C#N

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Molecular Weight: 479.37
Empirical Formula: C22H27BrN2O5

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 4.04
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 97
Number of rings: 2

     

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