COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK584067
Chemical Name: 2-chloro-5-[3-(quinolin-2-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]benzoicacid
Smiles: OC(=O)c1cc(ccc1Cl)n1c(=S)[nH]nc1c1ccc2c(n1)cccc2

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Molecular Weight: 382.83
Empirical Formula: C18H11ClN4O2S

Physical State: Dry powder
Available Amount: 285 mg

Lipinsky:
logP: 2.014
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 109
Number of rings: 4

     

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