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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H18FNO2.ClH
Molecular Weight 287.758
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LUBAZODONE HYDROCHLORIDE

SMILES

Cl.FC1=CC=C(OC[C@@H]2CNCCO2)C3=C1CCC3

InChI

InChIKey=HWEMEKZYQCJVEZ-PPHPATTJSA-N
InChI=1S/C14H18FNO2.ClH/c15-13-4-5-14(12-3-1-2-11(12)13)18-9-10-8-16-6-7-17-10;/h4-5,10,16H,1-3,6-9H2;1H/t10-;/m0./s1

HIDE SMILES / InChI
Lubazodone (YM 992) or (S)-2-[[(7-fluoro-4-indanyl)oxy]methyl]morpholine monohydrochloride, exhibited the biochemical profile of a selective serotonin (5-HT) reuptake inhibitor (SSRI) with 5-HT2A receptor antagonistic activity. It has been studied in the treatment of depression.

CNS Activity

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: P14842
Gene ID: 29595.0
Gene Symbol: Htr2a
Target Organism: Rattus norvegicus (Rat)
86.0 nM [Ki]
Target ID: P31652
Gene ID: 25553.0
Gene Symbol: Slc6a4
Target Organism: Rattus norvegicus (Rat)
21.0 nM [Ki]
PubMed

PubMed

TitleDatePubMed
Pharmacological studies on YM992, a novel antidepressant with selective serotonin re-uptake inhibitory and 5-HT2A receptor antagonistic activity.
1997 Jun 18
Assessment of the serotonin reuptake blocking property of YM992: electrophysiological studies in the rat hippocampus and dorsal raphe.
1999 Dec 15
YM 992. YM 35992.
1999 Jul
Effect of acute treatment with YM992 on extracellular norepinephrine levels in the rat frontal cortex.
2000 Apr 21
Effect of acute treatment with YM992 on extracellular serotonin levels in the rat frontal cortex.
2000 Apr 21
Investigation of the high partition of YM992, a novel antidepressant, in rat brain - in vitro and in vivo evidence for the high binding in brain and the high permeability at the BBB.
2002 Dec
Effect of YM992, a novel antidepressant with selective serotonin re-uptake inhibitory and 5-HT 2A receptor antagonistic activity, on a marble-burying behavior test as an obsessive-compulsive disorder model.
2002 Oct
Effects of serotonin (5-hydroxytryptamine, 5-HT) reuptake inhibition plus 5-HT(2A) receptor antagonism on the firing activity of norepinephrine neurons.
2002 Sep
Name Type Language
LUBAZODONE HYDROCHLORIDE
USAN  
USAN  
Official Name English
LUBAZODONE HCL
Common Name English
YM992
Code English
YM-992
Code English
LUBAZODONE HYDROCHLORIDE [USAN]
Common Name English
(S)-2-[[(7-Fluoro-4-indanyl)oxy]methyl]morpholine hydrochloride
Systematic Name English
YM-35992
Code English
SM-50C
Code English
MORPHOLINE, 2-(((7-FLUORO-2,3-DIHYDRO-1H-INDEN-4-YL)OXY)METHYL)-, HYDROCHLORIDE (2S)-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C265
Created by admin on Fri Dec 15 15:45:51 GMT 2023 , Edited by admin on Fri Dec 15 15:45:51 GMT 2023
Code System Code Type Description
PUBCHEM
157918
Created by admin on Fri Dec 15 15:45:51 GMT 2023 , Edited by admin on Fri Dec 15 15:45:51 GMT 2023
PRIMARY
MESH
C105748
Created by admin on Fri Dec 15 15:45:51 GMT 2023 , Edited by admin on Fri Dec 15 15:45:51 GMT 2023
PRIMARY
ChEMBL
CHEMBL1080884
Created by admin on Fri Dec 15 15:45:51 GMT 2023 , Edited by admin on Fri Dec 15 15:45:51 GMT 2023
PRIMARY
DRUG BANK
DBSALT002369
Created by admin on Fri Dec 15 15:45:51 GMT 2023 , Edited by admin on Fri Dec 15 15:45:51 GMT 2023
PRIMARY
EPA CompTox
DTXSID90167075
Created by admin on Fri Dec 15 15:45:51 GMT 2023 , Edited by admin on Fri Dec 15 15:45:51 GMT 2023
PRIMARY
FDA UNII
2KT2C544LR
Created by admin on Fri Dec 15 15:45:51 GMT 2023 , Edited by admin on Fri Dec 15 15:45:51 GMT 2023
PRIMARY
USAN
MM-20
Created by admin on Fri Dec 15 15:45:51 GMT 2023 , Edited by admin on Fri Dec 15 15:45:51 GMT 2023
PRIMARY
CAS
161178-10-5
Created by admin on Fri Dec 15 15:45:51 GMT 2023 , Edited by admin on Fri Dec 15 15:45:51 GMT 2023
PRIMARY
NCI_THESAURUS
C75980
Created by admin on Fri Dec 15 15:45:51 GMT 2023 , Edited by admin on Fri Dec 15 15:45:51 GMT 2023
PRIMARY
SMS_ID
300000044552
Created by admin on Fri Dec 15 15:45:51 GMT 2023 , Edited by admin on Fri Dec 15 15:45:51 GMT 2023
PRIMARY