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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Muscarinic acetylcholine receptor M1
Species	Rattus norvegicus (Rat)
Gene	Chrm1
Synonym	cholinergic receptor, muscarinic 1 cholinergic receptor, muscarinic 1, CNS cholinergic receptor M1 muscarinic acetylcholine receptor M1 receptor M1R Chrm-1 [ Show all ]
Disease	N/A for non-human GPCRs
Length	460
Amino acid sequence	MNTSVPPAVSPNITVLAPGKGPWQVAFIGITTGLLSLATVTGNLLVLISFKVNTELKTVNNYFLLSLACADLIIGTFSMNLYTTYLLMGHWALGTLACDLWLALDYVASNASVMNLLLISFDRYFSVTRPLSYRAKRTPRRAALMIGLAWLVSFVLWAPAILFWQYLVGERTVLAGQCYIQFLSQPIITFGTAMAAFYLPVTVMCTLYWRIYRETENRARELAALQGSETPGKGGGSSSSSERSQPGAEGSPESPPGRCCRCCRAPRLLQAYSWKEEEEEDEGSMESLTSSEGEEPGSEVVIKMPMVDSEAQAPTKQPPKSSPNTVKRPTKKGRDRGGKGQKPRGKEQLAKRKTFSLVKEKKAARTLSAILLAFILTWTPYNIMVLVSTFCKDCVPETLWELGYWLCYVNSTVNPMCYALCNKAFRDTFRLLLLCRWDKRRWRKIPKRPGSVHRTPSRQC
UniProt	P08482
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL276
IUPHAR	13
DrugBank	N/A

Ligand

Name	N-(2-aminoethyl)-4-chlorobenzamide
Molecular formula	C9H11ClN2O
IUPAC name	N-(2-aminoethyl)-4-chlorobenzamide
Molecular weight	198.65
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	0.7
Synonyms	CHEMBL338404 KBio3_002425 Ro-16-6491 Spectrum_000099 BBL018643 BRD-K44899736-003-02-1 IDI1_000673 Lopac-R-106 NCGC00015879-03 SPBio_002095 Tocris-0376 87235-61-8 CHEBI:92783 KBio2_003087 MolPort-003-844-520 NINDS_000673 Spectrum4_000880 AIHKMGLJGLKLSI-UHFFFAOYSA-N BDBM50063994 CTK7E8792 KBioGR_001579 NCGC00015879-01 Ro-166491 STL194214 BSPBio_003205 KBio1_000673 Lopac0_001103 NCGC00024560-01 Spectrum2_001968 UPCMLD0ENAT5970959:001 AC1L1HTW KBio2_005655 N- (2-AMINOETHYL)-4-CHLOROBENZAMIDE (RO-16-6491) Ro 16-6941 Spectrum5_001211 AKOS000147526 Benzamide, N-(2-aminoethyl)-4-chloro- DivK1c_000673 KBioSS_000519 NCGC00015879-02 SCHEMBL3506361 T8238 CCG-205179 KBio2_000519 MCULE-9707600472 NCGC00024560-02 Spectrum3_001603 ZINC2555368 AC1Q5E4X [ Show all ]
Inchi Key	AIHKMGLJGLKLSI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C9H11ClN2O/c10-8-3-1-7(2-4-8)9(13)12-6-5-11/h1-4H,5-6,11H2,(H,12,13)
PubChem CID	4289
ChEMBL	CHEMBL338404
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Potency	22.4 nM	PubChem BioAssay data set	ChEMBL

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