Prexasertib

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H19N7O2
Molecular Weight	365.3892
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Prexasertib

Structure Search

SMILES

COC1=CC=CC(OCCCN)=C1C2=CC(NC3=CN=C(C=N3)C#N)=NN2

InChI

InChIKey=DOTGPNHGTYJDEP-UHFFFAOYSA-N

InChI=1S/C18H19N7O2/c1-26-14-4-2-5-15(27-7-3-6-19)18(14)13-8-16(25-24-13)23-17-11-21-12(9-20)10-22-17/h2,4-5,8,10-11H,3,6-7,19H2,1H3,(H2,22,23,24,25)

HIDE SMILES / InChI

Molecular Formula	C18H19N7O2
Molecular Weight	365.3892
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 10:55:24 UTC 2023` Edited by `admin` on `Sat Dec 16 10:55:24 UTC 2023`
Record UNII	820NH671E6
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

Prexasertib

Official Name

English

LY2606368

Code

English

prexasertib [INN]

Common Name

English

Prexasertib [WHO-DD]

Common Name

English

LY-2606368

Code

English

5-[[5-[2-(3-Aminopropoxy)-6-methoxyphenyl]-1H-pyrazol-3-yl]amino]-2-pyrazinecarbonitrile

Systematic Name

English

2-Pyrazinecarbonitrile, 5-[[5-[2-(3-aminopropoxy)-6-methoxyphenyl]-1H-pyrazol-3-yl]amino]-

Systematic Name

English

PREXASERTIB [USAN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C129825

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

NCI_THESAURUS

C155927

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

Code System Code Type Description

WIKIPEDIA

Prexasertib

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

SMS_ID

100000166793

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

CAS

1234015-52-1

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

ChEMBL

CHEMBL3545377

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

USAN

CD-51

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

PUBCHEM

46700756

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

INN

10276

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

NCI_THESAURUS

C91392

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

ChEMBL

CHEMBL3544911

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

EVMPD

SUB181023

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

EPA CompTox

DTXSID301031326

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

DRUG BANK

DB12008

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

FDA UNII

820NH671E6

Created by admin on Sat Dec 16 10:55:24 UTC 2023 , Edited by admin on Sat Dec 16 10:55:24 UTC 2023

PRIMARY

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					1R5SAY853D

SERINE/THREONINE-PROTEIN KINASE CHK1

TARGET -> INHIBITOR

Amount:


					E4FZV27T6Z

Prexasertib lactate monohydrate

SALT/SOLVATE -> PARENT

Amount:


					S4D3L195S4

PREXASERTIB MESYLATE MONOHYDRATE

SALT/SOLVATE -> PARENT

Amount:


					9RFT476U2L

PREXASERTIB DIHYDROCHLORIDE

SALT/SOLVATE -> PARENT

Amount:


					453V3E6666

PREXASERTIB MESYLATE ANHYDROUS

SALT/SOLVATE -> PARENT

Amount:


					7PV3ZN32VG

Prexasertib lactate

SALT/SOLVATE -> PARENT

Amount:

Related Record Type Details


					820NH671E6

ACTIVE MOIETY

Amount: