COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK510769
Chemical Name: N-{3-bromo-4-[(2,4-dichlorobenzyl)oxy]-5-methoxybenzyl}-3-[(4-chlorobenzyl)sulfanyl]-4H-1,2,4-triazol-4-amine
Smiles: COc1cc(CNn2cnnc2SCc2ccc(cc2)Cl)cc(c1OCc1ccc(cc1Cl)Cl)Br

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Molecular Weight: 614.78
Empirical Formula: C24H20BrCl3N4O2S

Physical State: Dry powder
Available Amount: 201 mg

Lipinsky:
logP: 7.678
Rotatable bonds: 9
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 4

     

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