ABEMACICLIB

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H32F2N8
Molecular Weight	506.5934
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ABEMACICLIB

Structure Search

SMILES

CCN1CCN(CC2=CN=C(NC3=NC=C(F)C(=N3)C4=CC(F)=C5N=C(C)N(C(C)C)C5=C4)C=C2)CC1

InChI

InChIKey=UZWDCWONPYILKI-UHFFFAOYSA-N

InChI=1S/C27H32F2N8/c1-5-35-8-10-36(11-9-35)16-19-6-7-24(30-14-19)33-27-31-15-22(29)25(34-27)20-12-21(28)26-23(13-20)37(17(2)3)18(4)32-26/h6-7,12-15,17H,5,8-11,16H2,1-4H3,(H,30,31,33,34)

HIDE SMILES / InChI

Molecular Formula	C27H32F2N8
Molecular Weight	506.5934
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 `Sat Dec 16 09:18:46 UTC 2023` Edited by `admin` on `Sat Dec 16 09:18:46 UTC 2023`
Record UNII	60UAB198HK
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ABEMACICLIB

Official Name

English

Abemaciclib [WHO-DD]

Common Name

English

ABEMACICLIB [JAN]

Common Name

English

VERZENIO

Brand Name

English

LY2835219

Code

English

2-PYRIMIDINAMINE, N-(5-((4-ETHYL-1-PIPERAZINYL)METHYL)-2-PYRIDINYL)-5-FLUORO-4-(4-FLUORO-2-METHYL-1-(1-METHYLETHYL)-1H-BENZIMIDAZOL-6-YL)

Systematic Name

English

LY-2835219

Code

English

abemaciclib [INN]

Common Name

English

ABEMACICLIB [ORANGE BOOK]

Common Name

English

ABEMACICLIB [USAN]

Common Name

English

ABEMACICLIB [MI]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C129825

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

NDF-RT

N0000175605

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

NCI_THESAURUS

C2185

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

WHO-ATC

L01XE50

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

Code System Code Type Description

RXCUI

1946825

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

SMS_ID

100000160392

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

DRUG CENTRAL

5259

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

NCI_THESAURUS

C97660

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

WIKIPEDIA

Abemaciclib

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

ChEMBL

CHEMBL3301610

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

MERCK INDEX

m12043

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

INN

10036

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

EPA CompTox

DTXSID20673119

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

LACTMED

Abemaciclib

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

DRUG BANK

DB12001

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

FDA UNII

60UAB198HK

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

CAS

1231929-97-7

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

EVMPD

SUB171907

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

USAN

BC-21

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

PUBCHEM

46220502

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

DAILYMED

60UAB198HK

Created by admin on Sat Dec 16 09:18:46 UTC 2023 , Edited by admin on Sat Dec 16 09:18:46 UTC 2023

PRIMARY

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ATP-BINDING CASSETTE SUB-FAMILY G MEMBER 2

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ATP-BINDING CASSETTE SUB-FAMILY G MEMBER 2

TRANSPORTER -> SUBSTRATE


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EXCRETED UNCHANGED

Interaction Type:

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Qualification:

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MULTIDRUG RESISTANCE PROTEIN 1

TRANSPORTER -> INHIBITOR

Qualification:

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TARGET -> INHIBITOR

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MULTIDRUG RESISTANCE PROTEIN 1

TRANSPORTER -> SUBSTRATE


					GY5W0VY0MU

BT-474

CELL->INHIBITOR


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ABEMACICLIB MESYLATE

SALT/SOLVATE -> PARENT


					6D53G0FD0Z

PLASMA PROTEIN FRACTION (HUMAN)

BINDER->LIGAND

Interaction Type:

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Amount:

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ACTIVE MOIETY

Name	Property Type	Amount	Referenced Substance	Defining	Parameters	References
blood-to-plasma ration	PHARMACOKINETIC

Biological Half-life	PHARMACOKINETIC

Tmax	PHARMACOKINETIC

Volume of Distribution	PHARMACOKINETIC