COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK629843
Chemical Name: ethyl1'-tert-butyl-4'-hydroxy-8-nitro-2',6'-dioxo-1,1',2,4,4a,6'-hexahydro-2'H,3H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=NC(=O)N(C1=O)C(C)(C)C)O

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Molecular Weight: 473.49
Empirical Formula: C22H27N5O7

Physical State: Dry powder
Available Amount: 175 mg

Lipinsky:
logP: 2.23
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 148
Number of rings: 4

     

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