General Information of the Compound
| Compound ID |
CP0911222
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| Compound Name |
1-(4-(1H-pyrrolo[3,2-c]pyridin-1-yl)benzyl)-5-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
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| Structure |
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| Formula |
C24H16FN3O3
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| Molecular Weight |
413.408
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| Canonical SMILES |
O=C(O)c1cn(Cc2ccc(-n3ccc4cnccc43)cc2)c2cccc(F)c2c1=O
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| InChI |
InChI=1S/C24H16FN3O3/c25-19-2-1-3-21-22(19)23(29)18(24(30)31)14-27(21)13-15-4-6-17(7-5-15)28-11-9-16-12-26-10-8-20(16)28/h1-12,14H,13H2,(H,30,31)
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| InChIKey |
KNPYTSRWDFORAX-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