MK-7622

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H25N3O2
Molecular Weight	399.4849
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CC=C(CC2=CC3=C(N=CN([C@H]4CCCC[C@@H]4O)C3=O)C5=CC=CC=C25)C=N1

InChI

InChIKey=JUVQLZBJFOGEEO-GOTSBHOMSA-N

InChI=1S/C25H25N3O2/c1-16-10-11-17(14-26-16)12-18-13-21-24(20-7-3-2-6-19(18)20)27-15-28(25(21)30)22-8-4-5-9-23(22)29/h2-3,6-7,10-11,13-15,22-23,29H,4-5,8-9,12H2,1H3/t22-,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H25N3O2
Molecular Weight	399.4849
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Potency
Muscarinic acetylcholine receptor M1 169 Target ID: CHEMBL216 Sources: https://www.ncbi.nlm.nih.gov/pubmed/30034595	Positive Allosteric Modulator 179
Potassium voltage-gated channel subfamily H member 2 6 Target ID: Q12809\|\|\|Q9BUT7 Gene ID: 3757.0 Gene Symbol: KCNH2 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/30034595	Inhibitor 8297	60.0 µM [IC50]
Cytochrome P450 2C9 50 Target ID: CHEMBL3397 Sources: https://www.ncbi.nlm.nih.gov/pubmed/30034595	Inhibitor 8297	13.3 µM [IC50]

PubMed

Title	Date	PubMed
MK-7622: A First-in-Class M(1) Positive Allosteric Modulator Development Candidate.	2018 Jul 12	30034595
A Novel M(1) PAM VU0486846 Exerts Efficacy in Cognition Models without Displaying Agonist Activity or Cholinergic Toxicity.	2018 Sep 19	29701957

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:43:44 GMT 2023` Edited by `admin` on `Sat Dec 16 01:43:44 GMT 2023`
Record UNII	57R7D1Q49R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MK-7622

Common Name

English

BENZO(H)QUINAZOLIN-4(3H)-ONE, 3-((1S,2S)-2-HYDROXYCYCLOHEXYL)-6-((6-METHYL-3-PYRIDINYL)METHYL)-

Systematic Name

English

MK7622

Code

English

Code System Code Type Description

PUBCHEM

46207733