ELIMUSERTIB

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H21N7O
Molecular Weight	375.427
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H]1COCCN1C2=NC3=C(N=CC=C3C(=C2)C4=CC=NN4C)C5=CC=NN5

InChI

InChIKey=YBXRSCXGRPSTMW-CYBMUJFWSA-N

InChI=1S/C20H21N7O/c1-13-12-28-10-9-27(13)18-11-15(17-5-8-23-26(17)2)14-3-6-21-20(19(14)24-18)16-4-7-22-25-16/h3-8,11,13H,9-10,12H2,1-2H3,(H,22,25)/t13-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H21N7O
Molecular Weight	375.427
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Serine-protein kinase ATR 5 Target ID: CHEMBL5024 Sources: http://cancerres.aacrjournals.org/content/77/13_Supplement/836	Inhibitor 8146

Substance Class	Chemical Created by `admin` on `Sun Dec 18 13:21:33 UTC 2022` Edited by `admin` on `Sun Dec 18 13:21:33 UTC 2022`
Record UNII	7N13IK9LNH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ELIMUSERTIB

Official Name

English

BAY-1895344

Code

English

1,7-NAPHTHYRIDINE, 2-((3R)-3-METHYL-4-MORPHOLINYL)-4-(1-METHYL-1H-PYRAZOL-5-YL)-8-(1H-PYRAZOL-3-YL)-

Systematic Name

English

elimusertib [INN]

Common Name

English

Elimusertib [WHO-DD]

Common Name

English

Code System Code Type Description

INN

11490