COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546191
Chemical Name: methyl4-(1-{6-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methyl]-3-hydroxy-4-oxo-4H-pyran-2-yl}-3-methoxy-3-oxopropyl)benzoate
Smiles: COC(=O)CC(c1oc(CN2CCc3c(C2)cc(c(c3)OC)OC)cc(=O)c1O)c1ccc(cc1)C(=O)OC

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Molecular Weight: 537.57
Empirical Formula: C29H31NO9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.285
Rotatable bonds: 10
H-donors: 1
H-acceptors: 9
PSA: 120
Number of rings: 4

     

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