General Information of the Compound
| Compound ID |
CP0502355
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| Compound Name |
1-[4-[(3-amino-2-oxo-1H-pyrido[2,3-b]pyrazin-8-yl)oxy]naphthalen-1-yl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea
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| Structure |
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| Formula |
C25H16F4N6O3
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| Molecular Weight |
524.434
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| Canonical SMILES |
Nc1nc2nccc(Oc3ccc(NC(=O)Nc4cc(ccc4F)C(F)(F)F)c4ccccc34)c2[nH]c1=O
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| InChI |
InChI=1S/C25H16F4N6O3/c26-15-6-5-12(25(27,28)29)11-17(15)33-24(37)32-16-7-8-18(14-4-2-1-3-13(14)16)38-19-9-10-31-22-20(19)34-23(36)21(30)35-22/h1-11H,(H,34,36)(H2,30,31,35)(H2,32,33,37)
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| InChIKey |
APNHOLHSUFXQBY-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