General Information of the Compound
| Compound ID |
CP0430612
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| Compound Name |
N-[2-(2-methylpyridin-3-yl)-3-(trifluoromethyl)phenyl]-3-[3-(trifluoromethyl)pyridin-2-yl]benzamide
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| Structure |
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| Formula |
C26H17F6N3O
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| Molecular Weight |
501.43
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| Canonical SMILES |
Cc1ncccc1-c1c(NC(=O)c2cccc(c2)-c2ncccc2C(F)(F)F)cccc1C(F)(F)F
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| InChI |
InChI=1S/C26H17F6N3O/c1-15-18(8-4-12-33-15)22-19(25(27,28)29)9-3-11-21(22)35-24(36)17-7-2-6-16(14-17)23-20(26(30,31)32)10-5-13-34-23/h2-14H,1H3,(H,35,36)
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| InChIKey |
GXQQARVXYNJKOH-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