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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	CHEMBL236014
Molecular formula	C27H36Cl2FN5O2
IUPAC name	3-amino-N-[(2R)-1-[4-[2-[(1S)-1-amino-3-methylbutyl]-6-fluorophenyl]piperazin-1-yl]-3-(2,4-dichlorophenyl)-1-oxopropan-2-yl]propanamide
Molecular weight	552.516
Hydrogen bond acceptor	6
Hydrogen bond donor	3
XlogP	3.6
Synonyms	BDBM50214688 1-{4-[(1R)-2-(amino-3-methylbutyl)-6-fluorophenyl]-4-[(2R)-(3-aminopropionylamido)-3-(2,4-dichlorophenyl)propionyl]}-piperazine
Inchi Key	AEZCRBIFPKXUGD-BJKOFHAPSA-N
Inchi ID	InChI=1S/C27H36Cl2FN5O2/c1-17(2)14-23(32)20-4-3-5-22(30)26(20)34-10-12-35(13-11-34)27(37)24(33-25(36)8-9-31)15-18-6-7-19(28)16-21(18)29/h3-7,16-17,23-24H,8-15,31-32H2,1-2H3,(H,33,36)/t23-,24+/m0/s1
PubChem CID	44434562
ChEMBL	CHEMBL236014
IUPHAR	N/A
BindingDB	50214688
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
3966	Melanocortin receptor 3	P41968	MC3R	Homo sapiens (Human)	323
3965	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332
3967	Melanocortin receptor 5	P33032	MC5R	Homo sapiens (Human)	325

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