COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186486
Chemical Name: (2Z)-2-cyano-3-[1-(2-cyanobenzyl)-1H-indol-3-yl]-N-(3-ethoxyphenyl)prop-2-enamide
Smiles: CCOc1cccc(c1)NC(=O)/C(=C\c1cn(c2c1cccc2)Cc1ccccc1C#N)/C#N

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Molecular Weight: 446.51
Empirical Formula: C28H22N4O2

Physical State: Dry powder
Available Amount: 362 mg

Lipinsky:
logP: 5.64
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 90
Number of rings: 4

     

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