COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL186055
Chemical Name: 2-({4-benzyl-5-[(4-chlorophenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-phenylethanone
Smiles: Clc1ccc(cc1)OCc1nnc(n1Cc1ccccc1)SCC(=O)c1ccccc1

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Molecular Weight: 449.96
Empirical Formula: C24H20ClN3O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.267
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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