COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK021223
Chemical Name: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-(3-nitrophenyl)-2-(2-oxopyridin-1(2H)-yl)propane-1,3-dione
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)C(n1ccccc1=O)C(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 477.47
Empirical Formula: C25H23N3O7

Available Amount: 0 mg

Lipinsky:
logP: 3.368
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 121
Number of rings: 4

     

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