MDE HYDROCHLORIDE

Details

Stereochemistry	RACEMIC
Molecular Formula	C12H17NO2.ClH
Molecular Weight	243.73
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CCNC(C)CC1=CC2=C(OCO2)C=C1

InChI

InChIKey=IBDIPBWIXJRJQM-UHFFFAOYSA-N

InChI=1S/C12H17NO2.ClH/c1-3-13-9(2)6-10-4-5-11-12(7-10)15-8-14-11;/h4-5,7,9,13H,3,6,8H2,1-2H3;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	C12H17NO2
Molecular Weight	207.2689
Charge	0
Count

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

Approval Year

Targets

Primary Target	Pharmacology	Potency
Norepinephrine transporter 191 Target ID: CHEMBL222 Sources: https://www.ncbi.nlm.nih.gov/pubmed/22897747	Inhibitor 8297	1.02 µM [IC50]
Dopamine transporter 180 Target ID: CHEMBL238 Sources: https://www.ncbi.nlm.nih.gov/pubmed/22897747	Inhibitor 8297	9.3 µM [IC50]
Serotonin transporter 178 Target ID: CHEMBL228 Sources: https://www.ncbi.nlm.nih.gov/pubmed/22897747	Inhibitor 8297	1.27 µM [IC50]
Serotonin 1a (5-HT1a) receptor 172 Target ID: CHEMBL214 Sources: https://www.ncbi.nlm.nih.gov/pubmed/22897747	Binding Agent 1064	18.8 µM [Ki]
Alpha-2a adrenergic receptor 63 Target ID: CHEMBL1867 Sources: https://www.ncbi.nlm.nih.gov/pubmed/22897747	Binding Agent 1064	12.2 µM [Ki]

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:51:33 UTC 2023` Edited by `admin` on `Fri Dec 15 15:51:33 UTC 2023`
Record UNII	F5C0YRV9E3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MDE HYDROCHLORIDE

Common Name

English

MDEA HYDROCHLORIDE

Common Name

English

1,3-BENZODIOXOLE-5-ETHANAMINE, N-ETHYL-.ALPHA.-METHYL-, HYDROCHLORIDE (1:1)

Systematic Name

English

METHYLENEDIOXYETHAMPHETAMINE HYDROCHLORIDE

Common Name

English

EVE hydrochloride

Common Name

English

3,4-METHYLENEDIOXYETHYLAMPHETAMINE HYDROCHLORIDE

Common Name

English

3,4-Methylenedioxy-N-ethylamphetamine hydrochloride

Common Name

English

MDE HYDROCHLORIDE [MI]

Common Name

English

Code System Code Type Description

CAS

74341-78-9