COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK590534
Chemical Name: ethyl1'-benzyl-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)Cc1ccccc1)O

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Molecular Weight: 507.5
Empirical Formula: C25H25N5O7

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 2.833
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 148
Number of rings: 5

     

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