COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL564840
Chemical Name: 4-[(3E)-3-(hydroxyimino)-4-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)butyl]-2-methoxyphenol
Smiles: O/N=C(/CC1N(C)CCc2c1c(OC)c1c(c2)OCO1)\CCc1ccc(c(c1)OC)O

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Molecular Weight: 428.49
Empirical Formula: C23H28N2O6

Physical State: Liquid
Available Amount: 300 mg

Lipinsky:
logP: 3.21
Rotatable bonds: 9
H-donors: 2
H-acceptors: 6
PSA: 92
Number of rings: 4

     

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