COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150120
Chemical Name: 5-(4-tert-butylphenyl)-4-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(ccc1O)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 382.49
Empirical Formula: C20H22N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.983
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 101
Number of rings: 3

     

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