COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056052
Chemical Name: 4-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-5-(3-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cc(Br)ccc1O

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Molecular Weight: 419.3
Empirical Formula: C17H15BrN4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.288
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 101
Number of rings: 3

     

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