COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK448385
Chemical Name: 4-(4-chlorobenzyl)-5-(3,4-diethoxybenzyl)-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1cc(ccc1OCC)Cc1nnc(n1Cc1ccc(cc1)Cl)S

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Molecular Weight: 403.93
Empirical Formula: C20H22ClN3O2S

Physical State: Dry powder
Available Amount: 165 mg

Lipinsky:
logP: 5.862
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 87
Number of rings: 3

     

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