COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK235278
Chemical Name: methyl6-(4-hydroxyphenyl)-4,7-dioxo-2,3,4,6,7,8,9,10-octahydro-1H-pyrazino[1,2-a]quinoline-5-carboxylate
Smiles: COC(=O)C1=C2C(=O)NCCN2C2=C(C1c1ccc(cc1)O)C(=O)CCC2

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Molecular Weight: 368.39
Empirical Formula: C20H20N2O5

Physical State: Dry powder
Available Amount: 364 mg

Lipinsky:
logP: -0.496
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 95
Number of rings: 4

     

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