COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK596069
Chemical Name: (5Z)-5-{[(3-ethyl-2',6'-dihydroxy-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-6-hydroxy-3-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: CCN1CCN2C(C1)C1(Cc3c2ccc(c3)N/C=C\2/C(=NC(=O)N(C2=O)C(C)C)O)C(=NC(=NC1=O)O)O

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Molecular Weight: 523.55
Empirical Formula: C25H29N7O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.021
Rotatable bonds: 5
H-donors: 4
H-acceptors: 6
PSA: 170
Number of rings: 5

     

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