COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK931849
Chemical Name: ethyl4-{[(3-hydroxy-4,4-dimethyl-8-oxo-1-thioxo-1,4,7,8-tetrahydro-6H-pyrazolo[1,2-a][1,2,4]triazin-6-yl)carbonyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N2N1C(C)(C)C(=NC2=S)O

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Molecular Weight: 404.45
Empirical Formula: C18H20N4O5S

Available Amount: 0 mg

Lipinsky:
logP: 1.619
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 143
Number of rings: 3

     

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