COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186461
Chemical Name: (2Z)-2-cyano-N-(3-ethoxyphenyl)-3-{3-methoxy-4-[(4-nitrobenzyl)oxy]phenyl}prop-2-enamide
Smiles: CCOc1cccc(c1)NC(=O)/C(=C\c1ccc(c(c1)OC)OCc1ccc(cc1)[N+](=O)[O-])/C#N

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Molecular Weight: 473.49
Empirical Formula: C26H23N3O6

Physical State: Dry powder
Available Amount: 39 mg

Lipinsky:
logP: 5.388
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 126
Number of rings: 3

     

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