General Information of the Compound
| Compound ID |
CP0911221
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| Compound Name |
1-(4-(1H-pyrazol-1-yl)benzyl)-8-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
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| Structure |
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| Formula |
C20H14FN3O3
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| Molecular Weight |
363.348
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| Canonical SMILES |
O=C(O)c1cn(Cc2ccc(-n3cccn3)cc2)c2c(F)cccc2c1=O
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| InChI |
InChI=1S/C20H14FN3O3/c21-17-4-1-3-15-18(17)23(12-16(19(15)25)20(26)27)11-13-5-7-14(8-6-13)24-10-2-9-22-24/h1-10,12H,11H2,(H,26,27)
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| InChIKey |
SXJIWRKGAFTXQZ-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