COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK938271
Chemical Name: 2-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methyl]-5-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethoxy}-4H-pyran-4-one
Smiles: COc1cc2CN(CCc2cc1OC)Cc1occ(c(=O)c1)OCC(=O)N1CCN(CC1)c1ccc(cc1)F

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Molecular Weight: 537.59
Empirical Formula: C29H32FN3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.103
Rotatable bonds: 7
H-donors: 0
H-acceptors: 6
PSA: 80
Number of rings: 5

     

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