COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK307434
Chemical Name: 4-(3-ethoxypropyl)-5-{4-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}-4H-1,2,4-triazole-3-thiol
Smiles: CCOCCCn1c(S)nnc1c1ccc(cc1)Cn1ncc(c1)[N+](=O)[O-]

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Molecular Weight: 388.45
Empirical Formula: C17H20N6O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.334
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 142
Number of rings: 3

     

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