General Information of the Compound
| Compound ID |
CP0415073
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| Compound Name |
3-[[2-(2,6-dimethoxyphenoxy)ethylamino]methyl]-6,7-dimethoxy-2,3,4,10-tetrahydro-1H-acridin-9-one
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| Structure |
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| Formula |
C26H32N2O6
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| Molecular Weight |
468.55
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| Canonical SMILES |
COc1cc2nc3CC(CNCCOc4c(OC)cccc4OC)CCc3c(O)c2cc1OC
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| InChI |
InChI=1S/C26H32N2O6/c1-30-21-6-5-7-22(31-2)26(21)34-11-10-27-15-16-8-9-17-19(12-16)28-20-14-24(33-4)23(32-3)13-18(20)25(17)29/h5-7,13-14,16,27H,8-12,15H2,1-4H3,(H,28,29)
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| InChIKey |
VPMYQPYOAXNVFL-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