General Information of the Compound
| Compound ID |
CP0392134
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| Compound Name |
2-[5-[(5-chloro-2,3-dihydro-1H- inden-1-yl)oxy]pyrazol-1- yl]pyridine-4-carboxylic acid
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| Structure |
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| Formula |
C18H14ClN3O3
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| Molecular Weight |
355.781
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| Canonical SMILES |
OC(=O)c1ccnc(c1)-n1nccc1OC1CCc2cc(Cl)ccc12
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| InChI |
InChI=1S/C18H14ClN3O3/c19-13-2-3-14-11(9-13)1-4-15(14)25-17-6-8-21-22(17)16-10-12(18(23)24)5-7-20-16/h2-3,5-10,15H,1,4H2,(H,23,24)
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| InChIKey |
NFVXMQNDOGMBRE-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