COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK129751
Chemical Name: methyl2-{[({4-ethyl-5-[2-oxo-2-(phenylamino)ethyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Smiles: CCn1c(SCC(=O)Nc2ccccc2C(=O)OC)nnc1CC(=O)Nc1ccccc1

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Molecular Weight: 453.52
Empirical Formula: C22H23N5O4S

Physical State: Dry powder
Available Amount: 113 mg

Lipinsky:
logP: 3.786
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 140
Number of rings: 3

     

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