COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048514
Chemical Name: 4-[(E)-{[3-(2-fluorophenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]benzoicacid
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(=O)O

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Molecular Weight: 342.35
Empirical Formula: C16H11FN4O2S

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 2.824
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 109
Number of rings: 3

     

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