General Information of the Compound
| Compound ID |
CP0411997
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| Compound Name |
2-[5-(3-hydroxy-4- methylphenyl)-1-methyl-1H- imidazol-4-yl]pyridine-4- carboxylic acid
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| Structure |
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| Formula |
C17H15N3O3
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| Molecular Weight |
309.325
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| Canonical SMILES |
Cc1ccc(cc1O)-c1c(ncn1C)-c1cc(ccn1)C(O)=O
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| InChI |
InChI=1S/C17H15N3O3/c1-10-3-4-11(8-14(10)21)16-15(19-9-20(16)2)13-7-12(17(22)23)5-6-18-13/h3-9,21H,1-2H3,(H,22,23)
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| InChIKey |
KHSDTLGQWSEUAQ-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