COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK132726
Chemical Name: 2-[(4-ethyl-5-{2-[(3-methoxyphenyl)amino]-2-oxoethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-4-nitrophenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)Cc1nnc(n1CC)SCC(=O)Nc1ccc(cc1C)[N+](=O)[O-]

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Molecular Weight: 484.54
Empirical Formula: C22H24N6O5S

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 4.424
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 169
Number of rings: 3

     

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