COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK113598
Chemical Name: 3-[(4-bromobenzyl)sulfanyl]-5-(4-chlorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)Br)nnc1c1ccc(cc1)Cl

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Molecular Weight: 486.82
Empirical Formula: C22H17BrClN3OS

Physical State: Dry powder
Available Amount: 152 mg

Lipinsky:
logP: 8.282
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 65
Number of rings: 4

     

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