COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK246044
Chemical Name: 2-[(5-{2-[(3-methoxyphenyl)amino]-2-oxoethyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-5-nitrophenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)Cc1nnc(n1C)SCC(=O)Nc1cc(ccc1C)[N+](=O)[O-]

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Molecular Weight: 470.51
Empirical Formula: C21H22N6O5S

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 3.703
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 169
Number of rings: 3

     

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