ELACRIDAR

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C34H33N3O5
Molecular Weight	563.6429
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ELACRIDAR

Structure Search

SMILES

COC1=C(OC)C=C2CN(CCC3=CC=C(NC(=O)C4=C5NC6=C(OC)C=CC=C6C(=O)C5=CC=C4)C=C3)CCC2=C1

InChI

InChIKey=OSFCMRGOZNQUSW-UHFFFAOYSA-N

InChI=1S/C34H33N3O5/c1-40-28-9-5-7-26-32(28)36-31-25(33(26)38)6-4-8-27(31)34(39)35-24-12-10-21(11-13-24)14-16-37-17-15-22-18-29(41-2)30(42-3)19-23(22)20-37/h4-13,18-19H,14-17,20H2,1-3H3,(H,35,39)(H,36,38)

HIDE SMILES / InChI

Molecular Formula	C34H33N3O5
Molecular Weight	563.6429
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:39:11 UTC 2023` Edited by `admin` on `Fri Dec 15 15:39:11 UTC 2023`
Record UNII	N488540F94
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ELACRIDAR

Official Name

English

elacridar [INN]

Common Name

English

4-ACRIDINECARBOXAMIDE, N-(4-(2-(3,4-DIHYDRO-6,7-DIMETHOXY-2(1H)-ISOQUINOLINYL)ETHYL)PHENYL)-9,10-DIHYDRO-5-METHOXY-9-OXO-

Systematic Name

English

Elacridar [WHO-DD]

Common Name

English

LY-335979

Code

English

4'-(2-(3,4-DIHYDRO-6,7-DIMETHOXY-2(1H)-ISOQUINOLYL)ETHYL)-5-METHOXY-9-OXO-4-ACRIDANCARBOXANILIDE

Systematic Name

English

LY335979

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C1744

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

Code System Code Type Description

CAS

143664-11-3

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

PRIMARY

INN

7582

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

PRIMARY

EVMPD

SUB06475MIG

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

PRIMARY

ChEMBL

CHEMBL396298

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

PRIMARY

SMS_ID

100000080519

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

PRIMARY

NCI_THESAURUS

C73318

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

PRIMARY

DRUG BANK

DB04881

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

PRIMARY

FDA UNII

N488540F94

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

PRIMARY

PUBCHEM

119373

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

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MESH

C083501

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

PRIMARY

EPA CompTox

DTXSID90162489

Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023

PRIMARY

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					NX2BHH1A5B

ELACRIDAR HYDROCHLORIDE

SALT/SOLVATE -> PARENT

Amount:


					22ES734693

MULTIDRUG RESISTANCE PROTEIN 1

TRANSPORTER -> INHIBITOR

Comments:

DOUBLED THE CONCENTRATION OF R123

Qualification:

EC50

Amount:


					22ES734693

MULTIDRUG RESISTANCE PROTEIN 1

TRANSPORTER -> INHIBITOR

Amount:


					22ES734693

MULTIDRUG RESISTANCE PROTEIN 1

TARGET -> INHIBITOR

Amount:


					76UB6O122H

ATP-BINDING CASSETTE SUB-FAMILY G MEMBER 2

TARGET -> INHIBITOR

Amount:


					76UB6O122H

ATP-BINDING CASSETTE SUB-FAMILY G MEMBER 2

TRANSPORTER -> INDUCER

Related Record Type Details


					N488540F94

ELACRIDAR

ACTIVE MOIETY

Amount: