COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL461117
Chemical Name: 3-benzyl-5-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-4,7-dimethyl-2H-chromen-2-one
Smiles: Cc1cc(OCC(=O)N2CCC3(C(C2)CCCC3)O)c2c(c1)oc(=O)c(c2C)Cc1ccccc1

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Molecular Weight: 475.58
Empirical Formula: C29H33NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.046
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 76
Number of rings: 5

     

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