General Information of the Compound
Compound ID
CP0081916
Compound Name
5-oxo-6H-benzo[b][1]benzazepine-11-carboxamide
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Synonyms
10,11-Dihydro-10-oxo-5H-debenz(b,f)azepine-5-carboxamide
10,11-Dihydro-10-oxo-5H-dibenz(b,f)azepine-5-carboxamide
10,11-Dihydro-10-oxo-5H-dibenz[b,f]azepine-5-carboxamide
10,11-Dihydro-10-oxo-5H-dibenzo[b,f]azepine-5-carboxamide
10,11-Dihydro-10-oxo-5h-dibenz[b,f]azepine-5-carboxamide
10-Oxo-10,11-dihydro-5H-dibenzo[b,f]azepine-5-carboxamide
5-oxo-6H-benzo[b][1]benzazepine-11-carboxamide
Desitin brand of oxcarbazepine
Epilexter
Epliga
GP 47680
GP-47680
KIN-493
Novartis brand of oxcarbazepine
O0363
Oxacarbazepine
Oxaleptal (TN)
Oxcarbamazepine
Oxcarbazepime
Oxcarbazepina
Oxcarbazepina [INN-Spanish]
Oxcarbazepine
Oxcarbazepine (USAN/INN)
Oxcarbazepine [INN]
Oxcarbazepinum
Oxcarbazepinum [INN-Latin]
SPN-804
Timox
Trileptal
Trileptal (TN)
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Structure
Formula
C15H12N2O2
Molecular Weight
252.273
Canonical SMILES
NC(=O)N1c2ccccc2CC(=O)c2ccccc12
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InChI
InChI=1S/C15H12N2O2/c16-15(19)17-12-7-3-1-5-10(12)9-14(18)11-6-2-4-8-13(11)17/h1-8H,9H2,(H2,16,19)
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InChIKey
CTRLABGOLIVAIY-UHFFFAOYSA-N
CAS
28721-07-5
Physicochemical Property
logP
2.6422
Rotatable Bonds
0
Heavy Atom Count
19
Polar Areas
63.4
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
19

"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).

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PubChem ID
CID: 34312
SID: 15196775
ChEMBL ID
CHEMBL1068
DrugBank ID
DB00776
Map of Molecular Bioactivity Related to the Compound
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
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT06109, Geminin
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000015 SW480
 Cell Line Info 
Homo sapiens (Human)  1
1
Potency ~ 33498.3 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Protein ID: PT02908, P2X purinoceptor 4
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000094 1321N1
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 > 10000 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( Oxcarbazepine )
Drug Name Oxcarbazepine
Company Norvatis Phamaceuticals Corporation
Indication
Epilepsy
Approved
Target(s)
Voltage-gated sodium channel alpha Nav1.9 (SCN11A)
 Target Info 
Blocker