ZIMLOVISERTIB

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H20FN3O4
Molecular Weight	361.3675
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@H]1[C@@H](COC2=NC=CC3=C2C=C(OC)C(=C3)C(N)=O)NC(=O)[C@H]1F

InChI

InChIKey=JKDGKIBAOAFRPJ-ZBINZKHDSA-N

InChI=1S/C18H20FN3O4/c1-3-10-13(22-17(24)15(10)19)8-26-18-11-7-14(25-2)12(16(20)23)6-9(11)4-5-21-18/h4-7,10,13,15H,3,8H2,1-2H3,(H2,20,23)(H,22,24)/t10-,13+,15-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C18H20FN3O4
Molecular Weight	361.3675
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Interleukin-1 receptor-associated kinase 4 4 Target ID: Q9NWZ3 Gene ID: 51135.0 Gene Symbol: IRAK4 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/28498658	Inhibitor 8297		0.2 nM [IC50]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:24:11 GMT 2023` Edited by `admin` on `Sat Dec 16 11:24:11 GMT 2023`
Record UNII	S3F315JJXI
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ZIMLOVISERTIB

Official Name

English

6-ISOQUINOLINECARBOXAMIDE, 1-(((2S,3S,4S)-3-ETHYL-4-FLUORO-5-OXO-2-PYRROLIDINYL)METHOXY)-7-METHOXY-

Systematic Name

English

ZIMLOVISERTIB [USAN]

Common Name

English

PF-06650833

Code

English

PF 06650833

Common Name

English

zimlovisertib [INN]

Common Name

English

1-(((2S,3S,4S)-3-ETHYL-4-FLUORO-5-OXOPYRROLIDIN-2-YL)METHOXY)-7- METHOXYISOQUINOLINE-6-CARBOXAMIDE

Systematic Name

English

Zimlovisertib [WHO-DD]

Common Name

English

Code System Code Type Description

DRUG BANK

DB15143