COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK153960
Chemical Name: ethyl(2E)-2-cyano-3-(4-{2-[4-(hexyloxy)phenoxy]ethoxy}-3-methoxyphenyl)prop-2-enoate
Smiles: CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1OC)/C=C(/C(=O)OCC)\C#N

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Molecular Weight: 467.56
Empirical Formula: C27H33NO6

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 6.485
Rotatable bonds: 14
H-donors: 0
H-acceptors: 6
PSA: 87
Number of rings: 2

     

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