COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL348247
Chemical Name: 7-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-4-(trifluoromethyl)-2H-chromen-2-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)COc1ccc2c(c1)oc(=O)cc2C(F)(F)F

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Molecular Weight: 425.4
Empirical Formula: C21H22F3NO5

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.84
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 76
Number of rings: 4

     

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