COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK580584
Chemical Name: 4-[({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzonitrile
Smiles: CCOc1ccc(cc1)n1c(nnc1COc1ccc(cc1)Cl)SCc1ccc(cc1)C#N

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Molecular Weight: 476.99
Empirical Formula: C25H21ClN4O2S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 6.828
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 98
Number of rings: 4

     

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