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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	CID 44346805
Molecular formula	C75H92N18O20
IUPAC name	7-[[[(5S)-6-[[(2S)-1-[[(2S)-1-[(2S)-2-[(2-amino-2-oxoethyl)carbamoyl]pyrrolidin-1-yl]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-5-[[(2S)-2-[[(2S)-3-hydroxy-2-[[(2S)-2-[[(2S)-3-(1H-imidazol-4-yl)-2-[(5-oxopyrrolidine-2-carbonyl)oxyamino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-6-oxohexyl]amino]methyl]-4,5-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid
Molecular weight	1565.67
Hydrogen bond acceptor	24
Hydrogen bond donor	20
XlogP	-1.9
Synonyms	N/A
Inchi Key	PMIHBYVRQPZLRA-GZTIKPOLSA-N
Inchi ID	InChI=1S/C75H92N18O20/c1-37(2)23-51(66(103)87-49(12-7-21-81-75(77)78)72(109)93-22-8-13-56(93)71(108)83-34-59(76)98)88-65(102)48(11-5-6-20-79-31-39-24-45-61(57(96)26-39)64(101)62-46(63(45)100)27-40(73(110)111)29-58(62)97)86-67(104)52(25-38-14-16-43(95)17-15-38)89-70(107)55(35-94)91-68(105)53(28-41-32-82-47-10-4-3-9-44(41)47)90-69(106)54(30-42-33-80-36-84-42)92-113-74(112)50-18-19-60(99)85-50/h3-4,9-10,14-17,24,26-27,29,32-33,36-37,48-56,79,82,92,94-97H,5-8,11-13,18-23,25,28,30-31,34-35H2,1-2H3,(H2,76,98)(H,80,84)(H,83,108)(H,85,99)(H,86,104)(H,87,103)(H,88,102)(H,89,107)(H,90,106)(H,91,105)(H,110,111)(H4,77,78,81)/t48-,49-,50?,51-,52-,53-,54-,55-,56-/m0/s1
PubChem CID	44346805
ChEMBL	CHEMBL438099
IUPHAR	N/A
BindingDB	50105863
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
263282	Gonadotropin-releasing hormone receptor	P30969	Gnrhr	Rattus norvegicus (Rat)	327
263283	Lutropin-choriogonadotropic hormone receptor	P16235	Lhcgr	Rattus norvegicus (Rat)	700

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