General Information of the Compound
| Compound ID |
CP0382852
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| Compound Name |
N-[(6,7-dimethoxy-9-oxo-2,3,4,10-tetrahydro-1H-acridin-3-yl)methyl]furan-2-carboxamide
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| Structure |
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| Formula |
C21H22N2O5
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| Molecular Weight |
382.416
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| Canonical SMILES |
COc1cc2nc3CC(CNC(=O)c4ccco4)CCc3c(O)c2cc1OC
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| InChI |
InChI=1S/C21H22N2O5/c1-26-18-9-14-16(10-19(18)27-2)23-15-8-12(5-6-13(15)20(14)24)11-22-21(25)17-4-3-7-28-17/h3-4,7,9-10,12H,5-6,8,11H2,1-2H3,(H,22,25)(H,23,24)
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| InChIKey |
OOWAZNPOGJVTHK-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01089, Alpha-1A adrenergic receptor
Protein ID: PT01007, Alpha-1B adrenergic receptor
Protein ID: PT01004, Alpha-1D adrenergic receptor