COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK590011
Chemical Name: 4-(4-ethoxyphenyl)-3-[(4-nitrobenzyl)sulfanyl]-5-(thiophen-2-yl)-4H-1,2,4-triazole
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1cccs1

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Molecular Weight: 438.53
Empirical Formula: C21H18N4O3S2

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 6.61
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 139
Number of rings: 4

     

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