COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL182168
Chemical Name: 4-[({[5-benzyl-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: CC(Cn1c(SCC(=O)Nc2ccc(cc2)C(=O)O)nnc1Cc1ccccc1)C

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Molecular Weight: 424.52
Empirical Formula: C22H24N4O3S

Physical State: Dry powder
Available Amount: 87 mg

Lipinsky:
logP: 5.095
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 122
Number of rings: 3

     

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