COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043959
Chemical Name: 5-(4-tert-butylphenyl)-4-({(E)-[4-(pentyloxy)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCCCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 422.59
Empirical Formula: C24H30N4OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.604
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 81
Number of rings: 3

     

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