COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK582416
Chemical Name: 1'-[2-(3,4-dimethoxyphenyl)ethyl]-2'-hydroxy-3-methyl-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: COc1cc(CCN2C(=NC(=O)C3(C2=O)Cc2ccccc2N2C3CN(C)CC2)O)ccc1OC

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Molecular Weight: 478.55
Empirical Formula: C26H30N4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.67
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 94
Number of rings: 5

     

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