COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK302417
Chemical Name: 4-benzyl-5-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
Smiles: [O-][N+](=O)c1c(C)nn(c1C)CCc1nnc(n1Cc1ccccc1)S

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Molecular Weight: 358.42
Empirical Formula: C16H18N6O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.78
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 133
Number of rings: 3

     

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