COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL537176
Chemical Name: 7-[(3-bromobenzyl)oxy]-3-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4-methyl-2H-chromen-2-one
Smiles: Brc1cccc(c1)COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N1CCC2(C(C1)CCCC2)O

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Molecular Weight: 540.45
Empirical Formula: C28H30BrNO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.687
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 76
Number of rings: 5

     

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