COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549223
Chemical Name: methyl3-(6-{[6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-2(1H)-yl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-3-(4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-5-yl)propanoate
Smiles: COC(=O)CC(c1cc2cccc3c2n(c1=O)CC3)c1oc(CN2CCc3c(C2c2cc(OC)c(c(c2)OC)OC)cc(c(c3)OC)OC)cc(=O)c1O

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Molecular Weight: 738.79
Empirical Formula: C41H42N2O11

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.098
Rotatable bonds: 12
H-donors: 1
H-acceptors: 11
PSA: 142
Number of rings: 7

     

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