COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559099
Chemical Name: 4-[(E)-{[3-(pyridin-4-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)/C=N/n1c(n[nH]c1=S)c1ccncc1

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Molecular Weight: 325.35
Empirical Formula: C15H11N5O2S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 1.28
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 122
Number of rings: 3

     

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