COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK765200
Chemical Name: 1-[1-(5-bromo-2-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-chloroethanone
Smiles: ClCC(=O)N1CCc2c(C1c1cc(Br)ccc1F)cc(c(c2)OC)OC

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Molecular Weight: 442.71
Empirical Formula: C19H18BrClFNO3

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 3.828
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 38
Number of rings: 3

     

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