General Information of the Compound
| Compound ID |
CP0465219
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| Compound Name |
3-(3-chloropyridin-2-yl)-N-[2-pyridin-3-yl-3-(trifluoromethyl)phenyl]benzamide
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| Structure |
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| Formula |
C24H15ClF3N3O
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| Molecular Weight |
453.851
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| Canonical SMILES |
FC(F)(F)c1cccc(NC(=O)c2cccc(c2)-c2ncccc2Cl)c1-c1cccnc1
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| InChI |
InChI=1S/C24H15ClF3N3O/c25-19-9-4-12-30-22(19)15-5-1-6-16(13-15)23(32)31-20-10-2-8-18(24(26,27)28)21(20)17-7-3-11-29-14-17/h1-14H,(H,31,32)
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| InChIKey |
FOVUYWGGUYNFBG-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
Protein ID: PT01105, Sodium channel protein type 5 subunit alpha
Protein ID: PT01000, Sodium channel protein type 9 subunit alpha