COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK685672
Chemical Name: 3-methyl-8-nitro-1'-propyl-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: CCCN1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(C)CC1)[N+](=O)[O-]

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Molecular Weight: 401.42
Empirical Formula: C19H23N5O5

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 3.308
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 118
Number of rings: 4

     

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