COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK697033
Chemical Name: 4-ethyl-3-(2-methoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: COc1ccccc1c1nnc(n1CC)SCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 370.43
Empirical Formula: C18H18N4O3S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 4.633
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 111
Number of rings: 3

     

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