General Information of the Compound
| Compound ID |
CP0455741
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| Compound Name |
2-{1-[2-(morpholin-4-yl)ethyl]- 1H-imidazol-4-yl}pyridine-4- carboxylic acid
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| Structure |
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| Formula |
C15H18N4O3
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| Molecular Weight |
302.334
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| Canonical SMILES |
OC(=O)c1ccnc(c1)-c1cn(CCN2CCOCC2)cn1
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| InChI |
InChI=1S/C15H18N4O3/c20-15(21)12-1-2-16-13(9-12)14-10-19(11-17-14)4-3-18-5-7-22-8-6-18/h1-2,9-11H,3-8H2,(H,20,21)
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| InChIKey |
KGVYZQBMOYMEEW-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: PT02979, Lysine-specific demethylase 4C
Protein ID: PT02613, Lysine-specific demethylase 5A
Protein ID: PT03382, Lysine-specific demethylase 5B