COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK292943
Chemical Name: 3-{(E)-1-cyano-2-[5-nitro-2-(prop-2-yn-1-yloxy)phenyl]ethenyl}benzonitrile
Smiles: C#CCOc1ccc(cc1/C=C(\c1cccc(c1)C#N)/C#N)[N+](=O)[O-]

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Molecular Weight: 329.31
Empirical Formula: C19H11N3O3

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 4.011
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 2

     

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