COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK955558
Chemical Name: 1-(2,5-dichlorophenyl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone
Smiles: COc1c2c(CCN(C2CC(=O)c2cc(Cl)ccc2Cl)C)cc2c1OCO2

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Molecular Weight: 408.28
Empirical Formula: C20H19Cl2NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.735
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 48
Number of rings: 4

     

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