General Information of the Compound
| Compound ID |
CP0383372
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| Compound Name |
2-{1-[(4-methylmorpholin-2- yl)methyl]-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 |
CN1CCOC(Cn2cnc(c2)-c2cc(ccn2)C(O)=O)C1
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| InChI |
InChI=1S/C15H18N4O3/c1-18-4-5-22-12(7-18)8-19-9-14(17-10-19)13-6-11(15(20)21)2-3-16-13/h2-3,6,9-10,12H,4-5,7-8H2,1H3,(H,20,21)
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| InChIKey |
XVIKJBZPEYLLFN-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: PT03776, Lysine-specific demethylase 2B
Protein ID: PT02979, Lysine-specific demethylase 4C
Protein ID: PT02613, Lysine-specific demethylase 5A
Protein ID: PT03382, Lysine-specific demethylase 5B