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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	CHEMBL374912
Molecular formula	C54H86N14O13S
IUPAC name	(2S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]hexanoyl]amino]acetyl]amino]-4-methylsulfanylbutanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]acetyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Molecular weight	1171.43
Hydrogen bond acceptor	17
Hydrogen bond donor	16
XlogP	-2.5
Synonyms	BDBM50033564 Tyr-Ser-Phe-Lys-Gly-Met-Leu-Leu-Gly-Arg
Inchi Key	VLTFYLYXMZPPGW-AQJXLSMYSA-N
Inchi ID	InChI=1S/C54H86N14O13S/c1-31(2)24-40(48(75)61-29-45(72)63-39(53(80)81)15-11-22-59-54(57)58)65-50(77)41(25-32(3)4)66-49(76)38(20-23-82-5)62-44(71)28-60-47(74)37(14-9-10-21-55)64-51(78)42(27-33-12-7-6-8-13-33)67-52(79)43(30-69)68-46(73)36(56)26-34-16-18-35(70)19-17-34/h6-8,12-13,16-19,31-32,36-43,69-70H,9-11,14-15,20-30,55-56H2,1-5H3,(H,60,74)(H,61,75)(H,62,71)(H,63,72)(H,64,78)(H,65,77)(H,66,76)(H,67,79)(H,68,73)(H,80,81)(H4,57,58,59)/t36-,37-,38-,39-,40-,41-,42-,43-/m0/s1
PubChem CID	10464012
ChEMBL	CHEMBL374912
IUPHAR	N/A
BindingDB	50033564
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
358185	C5a anaphylatoxin chemotactic receptor 1	O70129	C5AR1	Cavia porcellus (Guinea pig)	345
358186	C5a anaphylatoxin chemotactic receptor 1	P21730	C5AR1	Homo sapiens (Human)	350

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