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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	1077-27-6
Molecular formula	C8H14O2S2
IUPAC name	5-[(3S)-dithiolan-3-yl]pentanoic acid
Molecular weight	206.318
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	1.7
Synonyms	(S)-lipoic acid 5-[(3S)-1,2-dithiolan-3-yl]pentanoic acid AKOS016842424 L-6,8-thioctic acid s-(-)-alpha-lipoic acid Thiogamma (S)-(-)-alpha -Lipoic acid, >=97% (HPLC) (S)-(-)-\|A-Lipoic Acid 1,2-Dithiolane-3-pentanoic acid, (3S)- 62-46-4 AS-35195 FT-0658236 Lipoec SCHEMBL2128472 UNII-J2Y905FQ57 (+)-1,2-Dithiolane-3-valeric Acid (S)-a-lipoic acid AGBQKNBQESQNJD-ZETCQYMHSA-N Byodinoral 300 KB-196423 NCGC00016032-01 TC-133635 (3S)-1,2-Dithiolane-3-pentanoic Acid (s)-(-)-alpha-lipoic acid (S)-Thioctic Acid 5-[(3S)-3-dithiolanyl]pentanoic acid AN-7040 CHEMBL1234071 L-6-thioctic acid S-LA Tiobec (S)-1,2-Dithiolane-3-pentanoic acid 1,2-Dithiolane-3-pentanoic acid, (S)- A801750 AX8017470 J2Y905FQ57 Lopac-T-5625 SLA ZINC1532729 (-)-Thioctic Acid (S)-alpha-Lipoic Acid 127254-35-7 AJ-26805 CHEBI:43796 L-1,2-dithiolane 3-valeric acid PubChem6068 Thioctic acid l-form (R)-(+)-\|A-Lipoic Acid (S)-(-)-lipoic acid 077L276 5-[(3S)-dithiolan-3-yl]pentanoic acid ANW-44890 CTK0H9520 L-Thioctic acid S-Lipoate UNII-73Y7P0K73Y component AGBQKNBQESQNJD-ZETCQYMHSA-N (S)-5-(1,2-Dithiolan-3-yl)pentanoic acid 1,2-Dithiolane-3-pentanoicacid, (3S)- AC1L9HGU BR-72935 KB-05524 MolPort-003-848-397 ST2402837 (3R)-1,2-Dithiolane-3-pentanoic Acid [ Show all ]
Inchi Key	AGBQKNBQESQNJD-ZETCQYMHSA-N
Inchi ID	InChI=1S/C8H14O2S2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H,9,10)/t7-/m0/s1
PubChem CID	445125
ChEMBL	CHEMBL1234071
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
4735	Muscarinic acetylcholine receptor M1	P08482	Chrm1	Rattus norvegicus (Rat)	460

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