COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK591529
Chemical Name: 3-ethyl-2'-hydroxy-1'-methyl-8-nitro-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: CCN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)C)O

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Molecular Weight: 387.4
Empirical Formula: C18H21N5O5

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 1.721
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 122
Number of rings: 4

     

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