COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK314921
Chemical Name: 4-benzyl-5-[1,3-dimethyl-6-(3-nitrophenyl)-1H-pyrazolo[3,4-b]pyridin-4-yl]-4H-1,2,4-triazole-3-thiol
Smiles: [O-][N+](=O)c1cccc(c1)c1cc(c2nnc(n2Cc2ccccc2)S)c2c(n1)n(C)nc2C

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Molecular Weight: 457.52
Empirical Formula: C23H19N7O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.902
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 146
Number of rings: 5

     

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