COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114092
Chemical Name: 4-({(E)-[3,5-dichloro-4-(prop-2-yn-1-yloxy)phenyl]methylidene}amino)-5-phenyl-4H-1,2,4-triazole-3-thiol
Smiles: C#CCOc1c(Cl)cc(cc1Cl)/C=N/n1c(S)nnc1c1ccccc1

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Molecular Weight: 403.29
Empirical Formula: C18H12Cl2N4OS

Physical State: Dry powder
Available Amount: 126 mg

Lipinsky:
logP: 6.496
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 91
Number of rings: 3

     

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