General Information of the Compound
| Compound ID |
CP0564391
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| Compound Name |
N-[2-(2,5-difluorophenyl)pyridin-4-yl]-2-(4-methylsulfonylphenyl)pyridin-4-amine
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| Formula |
C23H17F2N3O2S
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| Molecular Weight |
437.471
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| Canonical SMILES |
CS(=O)(=O)c1ccc(cc1)-c1cc(Nc2ccnc(c2)-c2cc(F)ccc2F)ccn1
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| InChI |
InChI=1S/C23H17F2N3O2S/c1-31(29,30)19-5-2-15(3-6-19)22-13-17(8-10-26-22)28-18-9-11-27-23(14-18)20-12-16(24)4-7-21(20)25/h2-14H,1H3,(H,26,27,28)
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| InChIKey |
QDFZWJGIFBXFLG-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