INDOCATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H26N2O2
Molecular Weight	350.454
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of INDOCATE

Structure Search

SMILES

CN(C)CCOC(=O)C1=CC2=C(C=C1)N(CC3=CC=CC=C3)C(C)=C2C

InChI

InChIKey=YKWQHMLRAPIWDP-UHFFFAOYSA-N

InChI=1S/C22H26N2O2/c1-16-17(2)24(15-18-8-6-5-7-9-18)21-11-10-19(14-20(16)21)22(25)26-13-12-23(3)4/h5-11,14H,12-13,15H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C22H26N2O2
Molecular Weight	350.454
Charge	0
Count

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

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/6322883 | Farmakologiya i Toksikologiya (Moscow) (1971), 34, (6), 663-6 | Farmakologiya i Toksikologiya (Moscow) (1971), 34, (2), 155-9

Indocate is indole derivative and monoamine oxidase inhibitor with peripheral antiserotonin properties.

Originator

Approval Year

Targets

Targets

Primary Target	Pharmacology	Condition	Potency
serotonin receptor signaling pathway 6 Target ID: GO:0007210 Sources: https://www.ncbi.nlm.nih.gov/pubmed/8371904 \| https://www.ncbi.nlm.nih.gov/pubmed/7903618 \| https://www.ncbi.nlm.nih.gov/pubmed/10776640	Inhibitor 8297

PubMed

PubMed

Title	Date	PubMed
[Effect of cyclic nucleotides on the sensitivity of early sea urchin embryos to cytotoxic neuropharmacological preparations].	1984 Mar	6322883

Patents

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:50:05 GMT 2023` Edited by `admin` on `Sat Dec 16 17:50:05 GMT 2023`
Record UNII	78D9U89TBG
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

INDOCATE

Official Name

English

indocate [INN]

Common Name

English

2-(DIMETHYLAMINO)ETHYL 1-BENZYL-2,3-DIMETHYLINDOLE-5-CARBOXYLATE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C66885

Created by admin on Sat Dec 16 17:50:05 GMT 2023 , Edited by admin on Sat Dec 16 17:50:05 GMT 2023

Code System Code Type Description

INN

3511

Created by admin on Sat Dec 16 17:50:05 GMT 2023 , Edited by admin on Sat Dec 16 17:50:05 GMT 2023

PRIMARY

SMS_ID

100000083392

Created by admin on Sat Dec 16 17:50:05 GMT 2023 , Edited by admin on Sat Dec 16 17:50:05 GMT 2023

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MESH

C036467

Created by admin on Sat Dec 16 17:50:05 GMT 2023 , Edited by admin on Sat Dec 16 17:50:05 GMT 2023

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EVMPD

SUB08177MIG

Created by admin on Sat Dec 16 17:50:05 GMT 2023 , Edited by admin on Sat Dec 16 17:50:05 GMT 2023

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PUBCHEM

65776

Created by admin on Sat Dec 16 17:50:05 GMT 2023 , Edited by admin on Sat Dec 16 17:50:05 GMT 2023

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FDA UNII

78D9U89TBG

Created by admin on Sat Dec 16 17:50:05 GMT 2023 , Edited by admin on Sat Dec 16 17:50:05 GMT 2023

PRIMARY

EPA CompTox

DTXSID6046137

Created by admin on Sat Dec 16 17:50:05 GMT 2023 , Edited by admin on Sat Dec 16 17:50:05 GMT 2023

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ChEMBL

CHEMBL1518149

Created by admin on Sat Dec 16 17:50:05 GMT 2023 , Edited by admin on Sat Dec 16 17:50:05 GMT 2023

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NCI_THESAURUS

C65912

Created by admin on Sat Dec 16 17:50:05 GMT 2023 , Edited by admin on Sat Dec 16 17:50:05 GMT 2023

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CAS

31386-25-1

Created by admin on Sat Dec 16 17:50:05 GMT 2023 , Edited by admin on Sat Dec 16 17:50:05 GMT 2023

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