COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK588201
Chemical Name: 5-(3-ethoxyphenyl)-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]nc1c1cccc(c1)OCC

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Molecular Weight: 410.54
Empirical Formula: C22H26N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.363
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 90
Number of rings: 3

     

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