COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK844374
Chemical Name: 2-(4-chlorophenyl)-1-(3,4-diethoxyphenyl)-6,7-diethoxy-1,4-dihydroisoquinolin-3(2H)-one
Smiles: CCOc1cc(ccc1OCC)C1c2cc(OCC)c(cc2CC(=O)N1c1ccc(cc1)Cl)OCC

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Molecular Weight: 510.03
Empirical Formula: C29H32ClNO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.608
Rotatable bonds: 9
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 4

     

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