General Information of the Compound
| Compound ID |
CP0470796
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| Compound Name |
2-[[7-chloro-4-hydroxy-2-oxo-1-[[4-(trifluoromethyl)phenyl]methyl]quinoline-3-carbonyl]amino]acetic acid
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| Structure |
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| Formula |
C20H14ClF3N2O5
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| Molecular Weight |
454.788
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| Canonical SMILES |
OC(=O)CNC(=O)c1c(O)c2ccc(Cl)cc2n(Cc2ccc(cc2)C(F)(F)F)c1=O
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| InChI |
InChI=1S/C20H14ClF3N2O5/c21-12-5-6-13-14(7-12)26(9-10-1-3-11(4-2-10)20(22,23)24)19(31)16(17(13)29)18(30)25-8-15(27)28/h1-7,29H,8-9H2,(H,25,30)(H,27,28)
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| InChIKey |
SZZIZAQWONFYCI-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: PT02612, Egl nine homolog 1
Protein ID: PT01988, Prolyl hydroxylase EGLN2
Protein ID: PT02885, Prolyl hydroxylase EGLN3