General Information of the Compound
| Compound ID |
CP0523859
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| Compound Name |
1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[3-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]phenyl]urea
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| Structure |
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| Formula |
C21H13F4N5O3
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| Molecular Weight |
459.359
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| Canonical SMILES |
Fc1ccc(cc1NC(=O)Nc1cccc(Oc2ccnc3[nH]c(=O)cnc23)c1)C(F)(F)F
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| InChI |
InChI=1S/C21H13F4N5O3/c22-14-5-4-11(21(23,24)25)8-15(14)29-20(32)28-12-2-1-3-13(9-12)33-16-6-7-26-19-18(16)27-10-17(31)30-19/h1-10H,(H,26,30,31)(H2,28,29,32)
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| InChIKey |
KZGFFASOKAYDRI-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