BMY-14802

OC(CCCN1CCN(CC1)C2=NC=C(F)C=N2)C3=CC=C(F)C=C3

InChIKey=ZXUYYZPJUGQHLQ-UHFFFAOYSA-N

InChI=1S/C18H22F2N4O/c19-15-5-3-14(4-6-15)17(25)2-1-7-23-8-10-24(11-9-23)18-21-12-16(20)13-22-18/h3-6,12-13,17,25H,1-2,7-11H2

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Targets

Primary Target	Pharmacology	Condition	Potency
Sigma non-opioid intracellular receptor 1 26 Target ID: Q99720\|\|\|Q7Z653 Gene ID: 10280.0 Gene Symbol: SIGMAR1 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/11784148	Antagonist 2778		265.0 nM [Ki]
Transmembrane protein 97 11 Target ID: Q5BJF2 Gene ID: 27346.0 Gene Symbol: TMEM97 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/11784148	Antagonist 2778		391.0 nM [Ki]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:21:36 GMT 2023` Edited by `admin` on `Sat Dec 16 08:21:36 GMT 2023`
Record UNII	A5NB5G07JO
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

BMY-14802

Common Name

English

.ALPHA.-(4-FLUOROPHENYL)-4-(5-FLUORO-2-PYRIMIDINYL)-1-PIPERAZINEBUTANOL

Systematic Name

English

ALPHA-(4-FLUOROPHENYL)-4-(5-FLUORO-2-PYRIMIDINYL)-1-PIPERAZINE BUTANOL

Common Name

English

BMS-181100

Code

English

(±)-BMY-14802

Code

English

1-PIPERAZINEBUTANOL, .ALPHA.-(4-FLUOROPHENYL)-4-(5-FLUORO-2-PYRIMIDINYL)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID70909596