General Information of the Compound
| Compound ID |
CP0366586
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| Compound Name |
3-(4-methoxyphenyl)-7-[2-(1,2,3,4-tetrahydroacridin-9-ylamino)ethoxy]chromen-4-one
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| Structure |
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| Formula |
C31H28N2O4
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| Molecular Weight |
492.575
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| Canonical SMILES |
COc1ccc(cc1)-c1coc2cc(OCCNc3c4CCCCc4nc4ccccc34)ccc2c1=O
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| InChI |
InChI=1S/C31H28N2O4/c1-35-21-12-10-20(11-13-21)26-19-37-29-18-22(14-15-25(29)31(26)34)36-17-16-32-30-23-6-2-4-8-27(23)33-28-9-5-3-7-24(28)30/h2,4,6,8,10-15,18-19H,3,5,7,9,16-17H2,1H3,(H,32,33)
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| InChIKey |
YLNDHUJSURMTDP-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