COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL123015
Chemical Name: N-{2-hydroxy-1-[4-methyl-5-({2-[(2-methyl-5-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Smiles: OCC(c1nnc(n1C)SCC(=O)Nc1cc(ccc1C)[N+](=O)[O-])NC(=O)c1ccccc1

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Molecular Weight: 470.51
Empirical Formula: C21H22N6O5S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 3.484
Rotatable bonds: 7
H-donors: 3
H-acceptors: 5
PSA: 180
Number of rings: 3

     

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