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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	Ac-dR[CEHdFRWC]-NH2
Molecular formula	C51H70N18O11S2
IUPAC name	3-[(4R,7S,10R,13R,16R,19S,22R)-22-[[(2S)-2-acetamido-5-(diaminomethylideneamino)pentanoyl]amino]-13-benzyl-4-carbamoyl-10-[3-(diaminomethylideneamino)propyl]-16-(1H-imidazol-5-ylmethyl)-7-(1H-indol-3-ylmethyl)-6,9,12,15,18,21-hexaoxo-1,2-dithia-5,8,11,14,17,20-hexazacyclotricos-19-yl]propanoic acid
Molecular weight	1175.36
Hydrogen bond acceptor	16
Hydrogen bond donor	16
XlogP	-3.0
Synonyms	CHEMBL267900 BDBM50165936 D07DWH
Inchi Key	UNXFCHHFXJFRRB-ABRXVHCYSA-N
Inchi ID	InChI=1S/C51H70N18O11S2/c1-27(70)62-33(13-7-17-58-50(53)54)43(74)69-40-25-82-81-24-39(42(52)73)68-47(78)37(20-29-22-60-32-12-6-5-11-31(29)32)66-44(75)34(14-8-18-59-51(55)56)63-46(77)36(19-28-9-3-2-4-10-28)65-48(79)38(21-30-23-57-26-61-30)67-45(76)35(64-49(40)80)15-16-41(71)72/h2-6,9-12,22-23,26,33-40,60H,7-8,13-21,24-25H2,1H3,(H2,52,73)(H,57,61)(H,62,70)(H,63,77)(H,64,80)(H,65,79)(H,66,75)(H,67,76)(H,68,78)(H,69,74)(H,71,72)(H4,53,54,58)(H4,55,56,59)/t33-,34+,35-,36+,37-,38+,39-,40-/m0/s1
PubChem CID	44400402
ChEMBL	CHEMBL267900
IUPHAR	N/A
BindingDB	50165936
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. 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
341291	Melanocortin receptor 3	P41968	MC3R	Homo sapiens (Human)	323
341293	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332
341294	Melanocortin receptor 4	P70596	Mc4r	Rattus norvegicus (Rat)	332
341295	Melanocortin receptor 5	P33032	MC5R	Homo sapiens (Human)	325
341292	Melanocyte-stimulating hormone receptor	Q01726	MC1R	Homo sapiens (Human)	317

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