PRE-084 hydrochloride

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H27NO3.ClH
Molecular Weight	353.884
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.O=C(OCCN1CCOCC1)C2(CCCCC2)C3=CC=CC=C3

InChI

InChIKey=QUJWFJNHTBKCLU-UHFFFAOYSA-N

InChI=1S/C19H27NO3.ClH/c21-18(23-16-13-20-11-14-22-15-12-20)19(9-5-2-6-10-19)17-7-3-1-4-8-17;/h1,3-4,7-8H,2,5-6,9-16H2;1H

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	C19H27NO3
Molecular Weight	317.4226
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Potency
Sigma non-opioid intracellular receptor 1 26 Target ID: Q60492 Gene ID: 1.00135592E8 Gene Symbol: SIGMAR1 Target Organism: Cavia porcellus (Guinea pig) Sources: https://www.ncbi.nlm.nih.gov/pubmed/14691051	Agonist 2752	9.0 nM [Ki]
dopamine receptor D2 4 Target ID: 1.00732584E8 Gene Symbol: Drd2 Sources: https://www.ncbi.nlm.nih.gov/pubmed/1658302	Binding Agent 1076	557.0 µM [IC50]
Muscarinic acetylcholine receptor (Cavia porcellus) 2 Target ID: Muscarinic acetylcholine receptor (Cavia porcellus) Sources: https://www.ncbi.nlm.nih.gov/pubmed/1658302	Binding Agent 1076	13.95 µM [IC50]
Serotonin 2 (5-HT2) receptor (Cavia porcellus) 2 Target ID: Serotonin 2 (5-HT2) receptor (Cavia porcellus) Sources: https://www.ncbi.nlm.nih.gov/pubmed/1658302	Binding Agent 1076	18.75 µM [IC50]

Substance Class	Chemical Created by `admin` on `Wed Apr 02 14:15:51 GMT 2025` Edited by `admin` on `Wed Apr 02 14:15:51 GMT 2025`
Record UNII	UC7TX5NVC2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PRE-084 hydrochloride

Common Name

English

2-Morpholinoethyl 1-phenylcyclohexanecarboxylate hydrochloride

Preferred Name

English

Cyclohexanecarboxylic acid, 1-phenyl-, 2-(4-morpholinyl)ethyl ester, hydrochloride (1:1)

Systematic Name

English

Cyclohexanecarboxylic acid, 1-phenyl-, 2-(4-morpholinyl)ethyl ester, hydrochloride

Systematic Name

English

Code System Code Type Description

CAS

75136-54-8

Created by admin on Wed Apr 02 14:15:51 GMT 2025 , Edited by admin on Wed Apr 02 14:15:51 GMT 2025

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PUBCHEM

11314197

Created by admin on Wed Apr 02 14:15:51 GMT 2025 , Edited by admin on Wed Apr 02 14:15:51 GMT 2025

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FDA UNII

UC7TX5NVC2

Created by admin on Wed Apr 02 14:15:51 GMT 2025 , Edited by admin on Wed Apr 02 14:15:51 GMT 2025

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EPA CompTox

DTXSID801017460

Created by admin on Wed Apr 02 14:15:51 GMT 2025 , Edited by admin on Wed Apr 02 14:15:51 GMT 2025

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Related Record Type Details


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PRE-084

PARENT -> SALT/SOLVATE

Amount: