General Information of the Compound
| Compound ID |
CP0484419
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| Compound Name |
1-N'-[3-fluoro-4-(5-methyl-6-phenylmethoxypyrrolo[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 |
C31H25F2N5O4
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| Molecular Weight |
569.568
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| Canonical SMILES |
Cc1c(OCc2ccccc2)cn2ncnc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)c12
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| InChI |
InChI=1S/C31H25F2N5O4/c1-19-26(41-17-20-5-3-2-4-6-20)16-38-27(19)28(34-18-35-38)42-25-12-11-23(15-24(25)33)37-30(40)31(13-14-31)29(39)36-22-9-7-21(32)8-10-22/h2-12,15-16,18H,13-14,17H2,1H3,(H,36,39)(H,37,40)
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| InChIKey |
VSOIWIUQQJTAAL-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