COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK126434
Chemical Name: 1-(4-bromophenyl)-2-(4-chlorophenyl)-6,7-diethoxy-1,4-dihydroisoquinolin-3(2H)-one
Smiles: CCOc1cc2c(cc1OCC)CC(=O)N(C2c1ccc(cc1)Br)c1ccc(cc1)Cl

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Molecular Weight: 500.82
Empirical Formula: C25H23BrClNO3

Physical State: Dry powder
Available Amount: 595 mg

Lipinsky:
logP: 6.58
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 38
Number of rings: 4

     

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