COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL177630
Chemical Name: 4-{[(E)-{4-methoxy-3-[(2,4,6-trichlorophenoxy)methyl]phenyl}methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1COc1c(Cl)cc(cc1Cl)Cl)/C=N/n1cnnc1S

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Molecular Weight: 443.74
Empirical Formula: C17H13Cl3N4O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.898
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 100
Number of rings: 3

     

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