COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK116776
Chemical Name: 3-({[(4-ethyl-5-{2-methyl-1-[(phenylcarbonyl)amino]propyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoicacid
Smiles: CCn1c(SCC(=O)Nc2cccc(c2)C(=O)O)nnc1C(C(C)C)NC(=O)c1ccccc1

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Molecular Weight: 481.58
Empirical Formula: C24H27N5O4S

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 4.458
Rotatable bonds: 9
H-donors: 3
H-acceptors: 4
PSA: 151
Number of rings: 3

     

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