COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548064
Chemical Name: methyl3-[3-(2-amino-2-oxoethoxy)phenyl]-3-{6-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methyl]-3-hydroxy-4-oxo-4H-pyran-2-yl}propanoate
Smiles: COC(=O)CC(c1oc(CN2CCc3c(C2)cc(c(c3)OC)OC)cc(=O)c1O)c1cccc(c1)OCC(=O)N

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Molecular Weight: 552.58
Empirical Formula: C29H32N2O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.848
Rotatable bonds: 13
H-donors: 3
H-acceptors: 9
PSA: 146
Number of rings: 4

     

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