COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL007843
Chemical Name: 1,3-dimethyl-7'-({(1E)-1-[2,4,6-trioxo-1-(prop-2-en-1-yl)tetrahydropyrimidin-5(2H)-ylidene]propyl}amino)-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trio
Smiles: C=CCN1C(=O)NC(=O)/C(=C(\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/CC)/C1=O

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Molecular Weight: 534.57
Empirical Formula: C27H30N6O6

Available Amount: 0 mg

Lipinsky:
logP: 0.072
Rotatable bonds: 3
H-donors: 2
H-acceptors: 6
PSA: 139
Number of rings: 5

     

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