COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL182570
Chemical Name: 3-({[(4-ethyl-5-{1-[(2-methoxyphenyl)amino]ethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoicacid
Smiles: COc1ccccc1NC(c1nnc(n1CC)SCC(=O)Nc1cccc(c1)C(=O)O)C

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Molecular Weight: 455.54
Empirical Formula: C22H25N5O4S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.09
Rotatable bonds: 9
H-donors: 3
H-acceptors: 4
PSA: 143
Number of rings: 3

     

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