COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK466134
Chemical Name: 5-(3,4-dimethoxybenzyl)-4-(2,3-dimethylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(ccc1OC)Cc1nnc(n1c1cccc(c1C)C)S

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Molecular Weight: 355.46
Empirical Formula: C19H21N3O2S

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 5.175
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 87
Number of rings: 3

     

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