General Information of the Compound
| Compound ID |
CP0555028
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| Compound Name |
N-[2-(2,5-difluorophenyl)pyridin-4-yl]-7-(4-methoxyphenyl)quinolin-4-amine
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| Formula |
C27H19F2N3O
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| Molecular Weight |
439.465
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| Canonical SMILES |
COc1ccc(cc1)-c1ccc2c(Nc3ccnc(c3)-c3cc(F)ccc3F)ccnc2c1
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| InChI |
InChI=1S/C27H19F2N3O/c1-33-21-6-2-17(3-7-21)18-4-8-22-25(11-13-31-26(22)14-18)32-20-10-12-30-27(16-20)23-15-19(28)5-9-24(23)29/h2-16H,1H3,(H,30,31,32)
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| InChIKey |
NPBRDPDGKBGKSL-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