COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL308281
Chemical Name: 2-[1-(1,3-benzodioxol-5-yl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-1-(4-chlorophenyl)ethanone
Smiles: Clc1ccc(cc1)C(=O)CN1CCC2(C(C1c1ccc3c(c1)OCO3)CCCC2)O

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Molecular Weight: 427.93
Empirical Formula: C24H26ClNO4

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 4.696
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 59
Number of rings: 5

     

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