COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183180
Chemical Name: (2E)-3-{4-[(2-chlorobenzyl)oxy]-3-ethoxy-5-(prop-2-en-1-yl)phenyl}-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
Smiles: CCOc1cc(/C=C(/C(=O)NCCc2c[nH]c3c2cccc3)\C#N)cc(c1OCc1ccccc1Cl)CC=C

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Molecular Weight: 540.06
Empirical Formula: C32H30ClN3O3

Physical State: Dry powder
Available Amount: 359 mg

Lipinsky:
logP: 6.717
Rotatable bonds: 12
H-donors: 2
H-acceptors: 3
PSA: 87
Number of rings: 4

     

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