COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK764466
Chemical Name: 1-[1-(5-bromo-2-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-3-methylbutan-1-one
Smiles: COc1cc2CCN(C(c2cc1OC)c1cc(Br)ccc1F)C(=O)CC(C)C

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Molecular Weight: 450.35
Empirical Formula: C22H25BrFNO3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.957
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 38
Number of rings: 3

     

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