General Information of the Compound
| Compound ID |
CP0495457
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| Compound Name |
5-(cyclohexylmethoxy)-3-[[2-hydroxyethyl-[(4-hydroxyphenyl)methyl]amino]methyl]chromen-4-one
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| Structure |
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| Formula |
C26H31NO5
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| Molecular Weight |
437.536
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| Canonical SMILES |
OCCN(Cc1ccc(O)cc1)Cc1coc2cccc(OCC3CCCCC3)c2c1=O
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| InChI |
InChI=1S/C26H31NO5/c28-14-13-27(15-19-9-11-22(29)12-10-19)16-21-18-32-24-8-4-7-23(25(24)26(21)30)31-17-20-5-2-1-3-6-20/h4,7-12,18,20,28-29H,1-3,5-6,13-17H2
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| InChIKey |
GYKLAJKYSFJKJS-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