COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL520111
Chemical Name: 2-{4-[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)sulfonyl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)S(=O)(=O)c1c2CCN(Cc2c(c2c1OCO2)OC)C

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Molecular Weight: 413.49
Empirical Formula: C18H27N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.715
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 100
Number of rings: 4

     

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