General Information of the Compound
| Compound ID |
CP0455761
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| Compound Name |
1-N'-[3-fluoro-4-[5-methyl-6-(2-morpholin-4-yl-2-oxoethoxy)pyrrolo[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 |
C30H28F2N6O6
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| Molecular Weight |
606.586
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| Canonical SMILES |
Cc1c(OCC(=O)N2CCOCC2)cn2ncnc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)c12
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| InChI |
InChI=1S/C30H28F2N6O6/c1-18-24(43-16-25(39)37-10-12-42-13-11-37)15-38-26(18)27(33-17-34-38)44-23-7-6-21(14-22(23)32)36-29(41)30(8-9-30)28(40)35-20-4-2-19(31)3-5-20/h2-7,14-15,17H,8-13,16H2,1H3,(H,35,40)(H,36,41)
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| InChIKey |
GMUQTOJABLIECV-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