COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK116328
Chemical Name: 4-{4-methyl-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}aniline
Smiles: Nc1ccc(cc1)c1nnc(n1C)SCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 341.39
Empirical Formula: C16H15N5O2S

Physical State: Dry powder
Available Amount: 34 mg

Lipinsky:
logP: 3.613
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 127
Number of rings: 3

     

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