COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK245639
Chemical Name: 2-[5-({2-[(4-methoxy-2-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-N-phenylacetamide
Smiles: COc1ccc(c(c1)[N+](=O)[O-])NC(=O)CSc1nnc(n1C)CC(=O)Nc1ccccc1

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Molecular Weight: 456.48
Empirical Formula: C20H20N6O5S

Physical State: Dry powder
Available Amount: 131 mg

Lipinsky:
logP: 2.92
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 169
Number of rings: 3

     

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