COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL443834
Chemical Name: 2-({[4-ethyl-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Smiles: CCn1c(SCc2ccccc2C#N)nnc1c1c[nH]c2c1cccc2

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Molecular Weight: 359.45
Empirical Formula: C20H17N5S

Physical State: Dry powder
Available Amount: 166 mg

Lipinsky:
logP: 4.533
Rotatable bonds: 5
H-donors: 1
H-acceptors: 0
PSA: 95
Number of rings: 4

     

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