COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK686822
Chemical Name: 3-benzyl-1'-methyl-8-nitro-3'-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)N(C)C(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)Cc1ccccc1)[N+](=O)[O-]

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Molecular Weight: 491.55
Empirical Formula: C26H29N5O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.504
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 109
Number of rings: 5

     

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