COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL123016
Chemical Name: methyl3-({[(5-{2-hydroxy-1-[(phenylcarbonyl)amino]ethyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate
Smiles: OCC(c1nnc(n1C)SCC(=O)Nc1cccc(c1)C(=O)OC)NC(=O)c1ccccc1

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Molecular Weight: 469.52
Empirical Formula: C22H23N5O5S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 3.014
Rotatable bonds: 9
H-donors: 3
H-acceptors: 5
PSA: 160
Number of rings: 3

     

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