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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	CHEMBL213752
Molecular formula	C34H44N6O3
IUPAC name	N-[(2R)-1-[(2R,4R)-2-[3-(diaminomethylideneamino)propyl]-4-(naphthalen-2-ylmethoxy)pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]piperidine-2-carboxamide
Molecular weight	584.765
Hydrogen bond acceptor	5
Hydrogen bond donor	4
XlogP	3.6
Synonyms	BDBM50191574 (S)-N-((R)-1-((2R,4R)-2-(3-guanidinopropyl)-4-(naphthalen-2-ylmethoxy)pyrrolidin-1-yl)-1-oxo-3-phenylpropan-2-yl)piperidine-2-carboxamide
Inchi Key	AIBOPTDBFGOAQA-AZEUVNARSA-N
Inchi ID	InChI=1S/C34H44N6O3/c35-34(36)38-18-8-13-28-21-29(43-23-25-15-16-26-11-4-5-12-27(26)19-25)22-40(28)33(42)31(20-24-9-2-1-3-10-24)39-32(41)30-14-6-7-17-37-30/h1-5,9-12,15-16,19,28-31,37H,6-8,13-14,17-18,20-23H2,(H,39,41)(H4,35,36,38)/t28-,29-,30?,31-/m1/s1
PubChem CID	44413969
ChEMBL	CHEMBL213752
IUPHAR	N/A
BindingDB	50191574
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
6071	Melanocortin receptor 3	P41968	MC3R	Homo sapiens (Human)	323
6070	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332
6072	Melanocyte-stimulating hormone receptor	Q01726	MC1R	Homo sapiens (Human)	317

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