COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL523513
Chemical Name: 1-{4-[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)sulfonyl]piperazin-1-yl}ethanone
Smiles: COc1c2CN(C)CCc2c(c2c1OCO2)S(=O)(=O)N1CCN(CC1)C(=O)C

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Molecular Weight: 411.48
Empirical Formula: C18H25N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.388
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 97
Number of rings: 4

     

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