MK-886

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H34ClNO2S
Molecular Weight	472.082
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)C1=CC=C2N(CC3=CC=C(Cl)C=C3)C(CC(C)(C)C(O)=O)=C(SC(C)(C)C)C2=C1

InChI

InChIKey=QAOAOVKBIIKRNL-UHFFFAOYSA-N

InChI=1S/C27H34ClNO2S/c1-17(2)19-10-13-22-21(14-19)24(32-26(3,4)5)23(15-27(6,7)25(30)31)29(22)16-18-8-11-20(28)12-9-18/h8-14,17H,15-16H2,1-7H3,(H,30,31)

HIDE SMILES / InChI

Molecular Formula	C27H34ClNO2S
Molecular Weight	472.082
Charge	0
Count

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

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Arachidonate 5-lipoxygenase-activating protein 3 Target ID: P20292 Gene ID: 241.0 Gene Symbol: ALOX5AP Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/2300173	Inhibitor 8297
Arachidonate 5-lipoxygenase-activating protein 3 Target ID: P20291 Gene ID: 29624.0 Gene Symbol: Alox5ap Target Organism: Rattus norvegicus (Rat) Sources: https://www.ncbi.nlm.nih.gov/pubmed/2300173	Inhibitor 8297

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:07:20 GMT 2023` Edited by `admin` on `Sat Dec 16 11:07:20 GMT 2023`
Record UNII	080626SQ8C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MK-886

Common Name

English

MK886

Code

English

CGS-81585

Code

English

J328.555C

Code

English

1-((4-CHLOROPHENYL)METHYL)-3-((1,1-DIMETHYLETHYL)THIO)-.ALPHA.,.ALPHA.-DIMETHYL-5-(1-METHYLETHYL)-1H-INDOLE-2-PROPANOIC ACID

Systematic Name

English

3-(1-(4-CHLOROBENZYL)-3-T-BUTYL-THIO-5-ISOPROPYLINDOL-2-YL)-2,2-DIMETHYLPROPANOIC ACID

Common Name

English

1H-INDOLE-2-PROPANOIC ACID, 1-((4-CHLOROPHENYL)METHYL)-3-((1,1-DIMETHYLETHYL)THIO)-.ALPHA.,.ALPHA.-DIMETHYL-5-(1-METHYLETHYL)-

Systematic Name

English

L-663536

Code

English

L-663,536

Code

English

Code System Code Type Description

WIKIPEDIA

L 663536