COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369459
Chemical Name: 2-[(2-chloro-6-ethoxy-4-{(E)-[(3-phenyl-5-sulfanyl-4H-1,2,4-triazol-4-yl)imino]methyl}phenoxy)methyl]benzonitrile
Smiles: CCOc1cc(/C=N/n2c(S)nnc2c2ccccc2)cc(c1OCc1ccccc1C#N)Cl

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Molecular Weight: 489.98
Empirical Formula: C25H20ClN5O2S

Physical State: Dry powder
Available Amount: 725 mg

Lipinsky:
logP: 7.549
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 124
Number of rings: 4

     

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