General Information of the Compound
Compound ID
CP0471435
Compound Name
10-Hydroxy-10,11-dihydro-dibenzo[b,f]azepine-5-carboxylic acid amide
    Show/Hide
Synonyms
(-)-10,11-Dihydro-10-hydroxy-5H-dibenz(b,f)azepine-5-carboxamide
10,11-Dihydro-10-hydroxy-5H-dibenz(b,f)azepine-5-carboxamide
10,11-Dihydro-10-hydroxycarbamazepine
10-HYDROXY-CARBAMAZEPINE
10-Hydroxy-10,11-dihydro-5H-dibenz(b,f)azepine-5-carboxamide
10-Hydroxy-10,11-dihydrocarbamazepine
10-Hydroxycarbamazepine
10-Hydroxycarbazepine
10-OH-Carbazepine
5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
GP 47779
GP-47779
Licarbazepine
    Show/Hide
Structure
Formula
C15H14N2O2
Molecular Weight
254.289
Canonical SMILES
NC(=O)N1c2ccccc2CC(O)c2ccccc12
    Show/Hide
InChI
InChI=1S/C15H14N2O2/c16-15(19)17-12-7-3-1-5-10(12)9-14(18)11-6-2-4-8-13(11)17/h1-8,14,18H,9H2,(H2,16,19)
    Show/Hide
InChIKey
BMPDWHIDQYTSHX-UHFFFAOYSA-N
CAS
29331-92-8
Physicochemical Property
logP
2.4929
Rotatable Bonds
0
Heavy Atom Count
19
Polar Areas
66.56
Hydrogen Bond Donor Count
2
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).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 114709
SID: 15122329
ChEMBL ID
CHEMBL1067
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: PT01019, 5-hydroxytryptamine receptor 2B
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
Ki > 10000 nM
   TI
   LI
   LO
   TS
Protein ID: PT02908, P2X purinoceptor 4
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000094 1321N1 Homo sapiens (Human)  1
1
IC50 > 100000 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( Licarbazepine )
Drug Name Licarbazepine
Company Novartis
Indication
Bipolar disorder
Discontinued in Phase 3