COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK549902
Chemical Name: [1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl](4-fluorophenyl)methanone
Smiles: CCOc1cc(ccc1OCC)CC1N(CCc2c1cc(OCC)c(c2)OCC)C(=O)c1ccc(cc1)F

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Molecular Weight: 521.63
Empirical Formula: C31H36FNO5

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 6.226
Rotatable bonds: 10
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 4

     

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