COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK552616
Chemical Name: [1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl][4-(morpholin-4-yl)-3-nitrophenyl]methanone
Smiles: CCOc1cc2c(cc1OCC)CCN(C2Cc1ccc(c(c1)OCC)OCC)C(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1

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Molecular Weight: 633.74
Empirical Formula: C35H43N3O8

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 6.257
Rotatable bonds: 11
H-donors: 0
H-acceptors: 8
PSA: 115
Number of rings: 5

     

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