General Information of the Compound
| Compound ID |
CP0508296
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| Compound Name |
1-(5-tert-butyl-2-phenylpyrazol-3-yl)-3-[2-fluoro-4-(3-morpholin-4-ylpyrido[2,3-b]pyrazin-8-yl)oxyphenyl]urea
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| Structure |
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| Formula |
C31H31FN8O3
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| Molecular Weight |
582.64
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| Canonical SMILES |
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4nc(cnc34)N3CCOCC3)cc2F)n(n1)-c1ccccc1
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| InChI |
InChI=1S/C31H31FN8O3/c1-31(2,3)25-18-26(40(38-25)20-7-5-4-6-8-20)37-30(41)35-23-10-9-21(17-22(23)32)43-24-11-12-33-29-28(24)34-19-27(36-29)39-13-15-42-16-14-39/h4-12,17-19H,13-16H2,1-3H3,(H2,35,37,41)
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| InChIKey |
HSQFEXKGMDKYHF-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