General Information of the Compound
| Compound ID |
CP0211545
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| Compound Name |
(R)-N-(1-((3-benzyl-3H-imidazo[4,5-b]pyridin-2-yl)methylamino)-1-oxo-3-(2-(trifluoromethyl)phenyl)propan-2-yl)-2-(trifluoromethoxy)benzamide
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| Structure |
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| Formula |
C32H25F6N5O3
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| Molecular Weight |
641.572
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| Canonical SMILES |
FC(F)(F)Oc1ccccc1C(=O)N[C@H](Cc1ccccc1C(F)(F)F)C(=O)NCc1nc2cccnc2n1Cc1ccccc1
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| InChI |
InChI=1S/C32H25F6N5O3/c33-31(34,35)23-13-6-4-11-21(23)17-25(42-29(44)22-12-5-7-15-26(22)46-32(36,37)38)30(45)40-18-27-41-24-14-8-16-39-28(24)43(27)19-20-9-2-1-3-10-20/h1-16,25H,17-19H2,(H,40,45)(H,42,44)/t25-/m1/s1
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| InChIKey |
CNJHIRPGEOQTTC-RUZDIDTESA-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: PT02752, Sodium channel protein type 10 subunit alpha
Protein ID: PT01000, Sodium channel protein type 9 subunit alpha