COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK577311
Chemical Name: 3-(1,3-benzodioxol-5-ylmethyl)-1',3'-dimethyl-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-]

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Molecular Weight: 507.5
Empirical Formula: C25H25N5O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.303
Rotatable bonds: 2
H-donors: 0
H-acceptors: 7
PSA: 128
Number of rings: 6

     

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