COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK104084
Chemical Name: 4-{[4-(benzyloxy)-3-methoxybenzylidene]amino}-5-(4-tert-butylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(ccc1OCc1ccccc1)/C=N/n1c(S)nnc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 472.61
Empirical Formula: C27H28N4O2S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 8.292
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 100
Number of rings: 4

     

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