COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL536946
Chemical Name: 5-{[1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-1-oxopropan-2-yl]oxy}-3,4,7-trimethyl-2H-chromen-2-one
Smiles: Cc1cc(OC(C(=O)N2CCC3(C(C2)CCCC3)O)C)c2c(c1)oc(=O)c(c2C)C

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Molecular Weight: 413.51
Empirical Formula: C24H31NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.783
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 76
Number of rings: 4

     

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