General Information of the Compound
| Compound ID |
CP0552547
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| Compound Name |
1-N'-[3-fluoro-4-(6-methoxy-5-methylpyrrolo[2,1-f][1,2,4]triazin-4-yl)oxyphenyl]-1-N-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide
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| Structure |
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| Formula |
C25H21F2N5O4
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| Molecular Weight |
493.47
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| Canonical SMILES |
COc1cn2ncnc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)c2c1C
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| InChI |
InChI=1S/C25H21F2N5O4/c1-14-20(35-2)12-32-21(14)22(28-13-29-32)36-19-8-7-17(11-18(19)27)31-24(34)25(9-10-25)23(33)30-16-5-3-15(26)4-6-16/h3-8,11-13H,9-10H2,1-2H3,(H,30,33)(H,31,34)
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| InChIKey |
KSXRLXDWKILACH-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