COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL182583
Chemical Name: 4-[({[4-(2-methylpropyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: CC(Cn1c(SCC(=O)Nc2ccc(cc2)C(=O)O)nnc1c1cccnc1)C

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Molecular Weight: 411.48
Empirical Formula: C20H21N5O3S

Physical State: Dry powder
Available Amount: 203 mg

Lipinsky:
logP: 4.434
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 135
Number of rings: 3

     

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