COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK055390
Chemical Name: N-[(E)-(3-iodo-5-methoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-4H-1,2,4-triazol-4-amine
Smiles: C=CCc1ccccc1OCCOc1c(I)cc(cc1OC)/C=N/n1cnnc1

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Molecular Weight: 504.33
Empirical Formula: C21H21IN4O3

Physical State: Dry powder
Available Amount: 201 mg

Lipinsky:
logP: 5.163
Rotatable bonds: 9
H-donors: 0
H-acceptors: 3
PSA: 70
Number of rings: 3

     

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