U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C9H19NO2.ClH
Molecular Weight 209.714
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IMAGABALIN HYDROCHLORIDE

SMILES

Cl.CCC[C@@H](C)C[C@H](N)CC(O)=O

InChI

InChIKey=CFMZXQJDAJXNHS-WLYNEOFISA-N
InChI=1S/C9H19NO2.ClH/c1-3-4-7(2)5-8(10)6-9(11)12;/h7-8H,3-6,10H2,1-2H3,(H,11,12);1H/t7-,8+;/m1./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C9H19NO2
Molecular Weight 173.2527
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Imagabalin is a ligand to the α(2)δ subunit of voltage-sensitive calcium channel and was developed to treat generalized anxiety disorder. Imagabalin was involved in phase III clinical trials when was made a decision to terminate all studies. However, this decision was not based on any safety concerns.

Approval Year

PubMed

PubMed

TitleDatePubMed
Methodology for rapid measures of glutamate release in rat brain slices using ceramic-based microelectrode arrays: basic characterization and drug pharmacology.
2011 Jul 15
Patents

Sample Use Guides

Dosage from: 50-100 mg oral capsule Dosage and frequency: 50-350 mg once or twice a day Duration: 6 months
Route of Administration: Oral
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:09:08 GMT 2023
Edited
by admin
on Fri Dec 15 16:09:08 GMT 2023
Record UNII
MJ3F8ZA7Q1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IMAGABALIN HYDROCHLORIDE
USAN  
USAN  
Official Name English
(3S,5R)-3-Amino-5-methyl-octanoic acid hydrochloride
Systematic Name English
IMAGABALIN HYDROCHLORIDE [USAN]
Common Name English
OCTANOIC ACID, 3-AMINO-5-METHYL-, HYDROCHLORIDE, (3S,5R)-
Common Name English
PD-0332334-0002
Code English
OCTANOIC ACID, 3-AMINO-5-METHYL-, HYDROCHLORIDE (1:1), (3S,5R)-
Common Name English
PF00195889-01
Code English
PF-00195889-01
Code English
PD 0332334-0002
Code English
IMAGABALIN HCL
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C28197
Created by admin on Fri Dec 15 16:09:08 GMT 2023 , Edited by admin on Fri Dec 15 16:09:08 GMT 2023
Code System Code Type Description
USAN
UU-112
Created by admin on Fri Dec 15 16:09:08 GMT 2023 , Edited by admin on Fri Dec 15 16:09:08 GMT 2023
PRIMARY
CAS
610300-00-0
Created by admin on Fri Dec 15 16:09:08 GMT 2023 , Edited by admin on Fri Dec 15 16:09:08 GMT 2023
PRIMARY
DRUG BANK
DBSALT002136
Created by admin on Fri Dec 15 16:09:08 GMT 2023 , Edited by admin on Fri Dec 15 16:09:08 GMT 2023
PRIMARY
SMS_ID
300000044507
Created by admin on Fri Dec 15 16:09:08 GMT 2023 , Edited by admin on Fri Dec 15 16:09:08 GMT 2023
PRIMARY
PUBCHEM
11701275
Created by admin on Fri Dec 15 16:09:08 GMT 2023 , Edited by admin on Fri Dec 15 16:09:08 GMT 2023
PRIMARY
FDA UNII
MJ3F8ZA7Q1
Created by admin on Fri Dec 15 16:09:08 GMT 2023 , Edited by admin on Fri Dec 15 16:09:08 GMT 2023
PRIMARY
ChEMBL
CHEMBL2103836
Created by admin on Fri Dec 15 16:09:08 GMT 2023 , Edited by admin on Fri Dec 15 16:09:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID40976533
Created by admin on Fri Dec 15 16:09:08 GMT 2023 , Edited by admin on Fri Dec 15 16:09:08 GMT 2023
PRIMARY
NCI_THESAURUS
C83786
Created by admin on Fri Dec 15 16:09:08 GMT 2023 , Edited by admin on Fri Dec 15 16:09:08 GMT 2023
PRIMARY
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