COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL472560
Chemical Name: 5-hydroxy-7-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)COc1cc(O)c2c(c1)OC(CC2=O)(C)C

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Molecular Weight: 403.48
Empirical Formula: C22H29NO6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.471
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 96
Number of rings: 4

     

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