COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL461095
Chemical Name: 4-butyl-7-{[1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-1-oxopropan-2-yl]oxy}-8-methyl-2H-chromen-2-one
Smiles: CCCCc1cc(=O)oc2c1ccc(c2C)OC(C(=O)N1CCC2(C(C1)CCCC2)O)C

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Molecular Weight: 441.57
Empirical Formula: C26H35NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.727
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 76
Number of rings: 4

     

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