COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL461087
Chemical Name: 4-ethyl-5-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-7-methyl-2H-chromen-2-one
Smiles: CCc1cc(=O)oc2c1c(OCC(=O)N1CCC3(C(C1)CCCC3)O)cc(c2)C

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Molecular Weight: 399.49
Empirical Formula: C23H29NO5

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 3.377
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 76
Number of rings: 4

     

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