COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK594045
Chemical Name: 3-[(4-bromobenzyl)sulfanyl]-5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(COc2ccc(cc2)Cl)nnc1SCc1ccc(cc1)Br

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Molecular Weight: 516.85
Empirical Formula: C23H19BrClN3O2S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 7.631
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 74
Number of rings: 4

     

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