COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK468071
Chemical Name: ethyl4-[({[4-ethyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)OCC)nnc1CCc1ccccc1

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Molecular Weight: 438.55
Empirical Formula: C23H26N4O3S

Physical State: Dry powder
Available Amount: 287 mg

Lipinsky:
logP: 5.644
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 111
Number of rings: 3

     

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