COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK251242
Chemical Name: 2-[(5-{2-[(2-methoxyphenyl)amino]-2-oxoethyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-nitrophenyl)acetamide
Smiles: COc1ccccc1NC(=O)Cc1nnc(n1C)SCC(=O)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 456.48
Empirical Formula: C20H20N6O5S

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 3.162
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 169
Number of rings: 3

     

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