Brief Information of the Compound and Protein
Compound Name
(1S)-1-[6-[4-(cyclopropylmethyl)-1-[4-(trifluoromethyl)phenyl]-3,5-dihydro-2H-1,4-benzodiazepin-7-yl]pyridin-2-yl]ethane-1,2-diol
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PubChem ID
CID: 118255669
Canonical SMILES
OC[C@@H](O)c1cccc(n1)-c1ccc2N(CCN(CC3CC3)Cc2c1)c1ccc(cc1)C(F)(F)F
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Compound Formula C27H28F3N3O2
Compound Structure
Protein Name
Sodium channel protein type 9 subunit alpha
Protein Classification
Ion channel
>
Voltage-gated ion channel
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Voltage-gated sodium channel
Uniprot ID
Q15858
Gene Name
SCN9A
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 = 1320 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 550 nM