COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK576629
Chemical Name: 3-acetyl-8-{[(E)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]amino}-1',3'-dimethyl-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: OC1=NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)C(=O)C)C(=O)N(C)C(=O)N(C2=O)C)/C(=N1)O

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Molecular Weight: 523.51
Empirical Formula: C24H25N7O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -2.456
Rotatable bonds: 2
H-donors: 3
H-acceptors: 7
PSA: 175
Number of rings: 5

     

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