COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK179184
Chemical Name: (2E)-2-cyano-3-{4-[(2-cyanobenzyl)oxy]-3-ethoxy-5-(prop-2-en-1-yl)phenyl}-N-(3-methoxyphenyl)prop-2-enamide
Smiles: CCOc1cc(/C=C(/C(=O)Nc2cccc(c2)OC)\C#N)cc(c1OCc1ccccc1C#N)CC=C

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Molecular Weight: 493.56
Empirical Formula: C30H27N3O4

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 6.112
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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