COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL408710
Chemical Name: 1-(azepan-1-yl)-3-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
Smiles: COc1cc2CN(CCC(=O)N3CCCCCC3)CCc2cc1OC

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Saltdata: HCl
Molecular Weight: 346.47
Empirical Formula: C20H30N2O3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.247
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 42
Number of rings: 3

     

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