COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183568
Chemical Name: N-[(E)-{2-bromo-4-[(3,4-dichlorobenzyl)oxy]-5-methoxyphenyl}methylidene]-4H-1,2,4-triazol-4-amine
Smiles: COc1cc(/C=N/n2cnnc2)c(cc1OCc1ccc(c(c1)Cl)Cl)Br

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Molecular Weight: 456.13
Empirical Formula: C17H13BrCl2N4O2

Physical State: Dry powder
Available Amount: 141 mg

Lipinsky:
logP: 5.311
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 61
Number of rings: 3

     

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