General Information of the Compound
| Compound ID |
CP0001524
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| Compound Name |
(E)-4-(5-ethoxypyridin-3-yl)-N-methylbut-3-en-1-amine
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| Synonyms |
TC-2559
TC2559
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| Structure |
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| Formula |
C12H18N2O
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| Molecular Weight |
206.289
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| Canonical SMILES |
CCOc1cncc(\C=C\CCNC)c1
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| InChI |
InChI=1S/C12H18N2O/c1-3-15-12-8-11(9-14-10-12)6-4-5-7-13-2/h4,6,8-10,13H,3,5,7H2,1-2H3/b6-4+
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| InChIKey |
HFZDMKMXPGRKCK-GQCTYLIASA-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