COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL523267
Chemical Name: 4-methoxy-6-methyl-9-{[4-(pyridin-2-ylmethyl)piperazin-1-yl]sulfonyl}-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-one
Smiles: COc1c2C(=O)N(C)CCc2c(c2c1OCO2)S(=O)(=O)N1CCN(CC1)Cc1ccccn1

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Saltdata: H2SO4
Molecular Weight: 474.54
Empirical Formula: C22H26N4O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.031
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 109
Number of rings: 5

     

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