COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL036446
Chemical Name: 1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methanamine
Smiles: COc1c2CN(C)CCc2c(c2c1OCO2)CN

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Saltdata: (COOH)2
Molecular Weight: 250.3
Empirical Formula: C13H18N2O3

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 0.969
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 56
Number of rings: 3

     

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