COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041370
Chemical Name: 4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1Br)/C=N/n1c(S)nnc1c1n[nH]c(c1)C

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Molecular Weight: 393.27
Empirical Formula: C14H13BrN6OS

Physical State: Dry powder
Available Amount: 234 mg

Lipinsky:
logP: 4.087
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 119
Number of rings: 3

     

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