COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL520441
Chemical Name: 2-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methyl]-5-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethoxy}-4H-pyran-4-one
Smiles: COc1cc2CN(CCc2cc1OC)Cc1occ(c(=O)c1)OCC(=O)N1CCN(CC1)c1ccccc1OC

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Molecular Weight: 549.62
Empirical Formula: C30H35N3O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.032
Rotatable bonds: 8
H-donors: 0
H-acceptors: 7
PSA: 90
Number of rings: 5

     

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