General Information of the Compound
| Compound ID |
CP0562764
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| Compound Name |
1-N'-[3-fluoro-4-[6-(2-hydroxyethylcarbamoyl)-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 |
C27H24F2N6O5
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| Molecular Weight |
550.522
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| Canonical SMILES |
Cc1c(cn2ncnc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)c12)C(=O)NCCO
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| InChI |
InChI=1S/C27H24F2N6O5/c1-15-19(23(37)30-10-11-36)13-35-22(15)24(31-14-32-35)40-21-7-6-18(12-20(21)29)34-26(39)27(8-9-27)25(38)33-17-4-2-16(28)3-5-17/h2-7,12-14,36H,8-11H2,1H3,(H,30,37)(H,33,38)(H,34,39)
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| InChIKey |
WVMWCXVRAZDTJP-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