COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL177600
Chemical Name: 4-{[(E)-{3-[(4-chloro-3,5-dimethylphenoxy)methyl]-4-methoxyphenyl}methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1COc1cc(C)c(c(c1)C)Cl)/C=N/n1cnnc1S

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Molecular Weight: 402.9
Empirical Formula: C19H19ClN4O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.69
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 100
Number of rings: 3

     

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