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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	cremastrine
Molecular formula	C14H25NO3
IUPAC name	[(1S,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (2R,3R)-2-hydroxy-3-methylpentanoate
Molecular weight	255.358
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	2.2
Synonyms	CHEMBL480464 pentanoic acid, 2-hydroxy-3-methyl-, [(1S,7aS)-hexahydro-1H-pyrrolizin-1-yl]methyl ester, (2R,3R)- BDBM50259847 [(1S,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (2R,3R)-2-hydroxy-3-methylpentanoate D0Z5RQ AC1LCUUY [ Show all ]
Inchi Key	AVBKRVFZNFJQBK-FVCCEPFGSA-N
Inchi ID	InChI=1S/C14H25NO3/c1-3-10(2)13(16)14(17)18-9-11-6-8-15-7-4-5-12(11)15/h10-13,16H,3-9H2,1-2H3/t10-,11-,12+,13-/m1/s1
PubChem CID	656392
ChEMBL	CHEMBL480464
IUPHAR	N/A
BindingDB	50259847
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
15155	Muscarinic acetylcholine receptor M1	P11229	CHRM1	Homo sapiens (Human)	460
15156	Muscarinic acetylcholine receptor M2	P08172	CHRM2	Homo sapiens (Human)	466
15157	Muscarinic acetylcholine receptor M3	P20309	CHRM3	Homo sapiens (Human)	590
15153	Muscarinic acetylcholine receptor M4	P08173	CHRM4	Homo sapiens (Human)	479
15154	Muscarinic acetylcholine receptor M5	P08912	CHRM5	Homo sapiens (Human)	532

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