General Information of the Compound
| Compound ID |
CP0459593
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| Compound Name |
2-{[R-(-)-Apomorphine-2'-oxy]ethoxy}-ethanol
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| Synonyms |
2-{[R-(-)-Apomorphine-2'-oxy]ethoxy}-ethanol
BDBM50251329
CHEMBL516151
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| Structure |
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| Formula |
C21H25NO5
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| Molecular Weight |
371.433
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| Canonical SMILES |
CN1CCc2cc(OCCOCCO)cc-3c2[C@H]1Cc1ccc(O)c(O)c-31
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| InChI |
InChI=1S/C21H25NO5/c1-22-5-4-14-10-15(27-9-8-26-7-6-23)12-16-19(14)17(22)11-13-2-3-18(24)21(25)20(13)16/h2-3,10,12,17,23-25H,4-9,11H2,1H3/t17-/m1/s1
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| InChIKey |
LUIRUBNQVJTQKP-QGZVFWFLSA-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
Clinical Information about the Compound