COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038282
Chemical Name: 5-(3,4-dimethoxyphenyl)-4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CSc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccc(c(c1)OC)OC

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Molecular Weight: 386.5
Empirical Formula: C18H18N4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.249
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 115
Number of rings: 3

     

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