COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL537050
Chemical Name: 3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4,11-dimethyl-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-2-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2

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Molecular Weight: 477.6
Empirical Formula: C29H35NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.145
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 79
Number of rings: 6

     

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