COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051204
Chemical Name: {2-[(E)-{[3-(5-phenyl-1H-pyrazol-3-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccccc1/C=N/n1c(=S)[nH]nc1c1n[nH]c(c1)c1ccccc1

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Molecular Weight: 420.45
Empirical Formula: C20H16N6O3S

Physical State: Dry powder
Available Amount: 203 mg

Lipinsky:
logP: 1.605
Rotatable bonds: 7
H-donors: 3
H-acceptors: 3
PSA: 147
Number of rings: 4

     

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