COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185278
Chemical Name: (2E)-2-cyano-3-{4-[(3,4-dichlorobenzyl)oxy]-3-ethoxy-5-(prop-2-en-1-yl)phenyl}-N-(4-methoxybenzyl)prop-2-enamide
Smiles: CCOc1cc(/C=C(/C(=O)NCc2ccc(cc2)OC)\C#N)cc(c1OCc1ccc(c(c1)Cl)Cl)CC=C

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Molecular Weight: 551.47
Empirical Formula: C30H28Cl2N2O4

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 7.109
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 80
Number of rings: 3

     

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