COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK110946
Chemical Name: 3-[(4-bromobenzyl)sulfanyl]-4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazole
Smiles: Clc1ccc(cc1)n1c(SCc2ccc(cc2)Br)nnc1c1ccccc1

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Molecular Weight: 456.79
Empirical Formula: C21H15BrClN3S

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 8.197
Rotatable bonds: 2
H-donors: 0
H-acceptors: 0
PSA: 56
Number of rings: 4

     

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