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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	MLS000324743
Molecular formula	C27H29N3O5
IUPAC name	methyl 2-[[[5-methyl-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]phenyl]-phenylmethyl]amino]acetate
Molecular weight	475.545
Hydrogen bond acceptor	6
Hydrogen bond donor	3
XlogP	4.2
Synonyms	methyl 2-[[[5-methyl-2-[2-(phenylmethoxycarbonylamino)ethanoylamino]phenyl]-phenyl-methyl]amino]ethanoate 2-[[[2-[[2-(benzyloxycarbonylamino)acetyl]amino]-5-methyl-phenyl]-phenyl-methyl]amino]acetic acid methyl ester HMS2362I09 SMR000163715 AC1MS2OB methyl 2-[[[5-methyl-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]phenyl]-phenylmethyl]amino]acetate CHEMBL1573548 MolPort-002-810-118 2-[[[5-methyl-2-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]phenyl]-phenylmethyl]amino]acetic acid methyl ester MCULE-2855448870 BDBM62087 methyl {[{2-[({[(benzyloxy)carbonyl]amino}acetyl)amino]-5-methylphenyl}(phenyl)methyl]amino}acetate cid_3527724 REGID_for_CID_3527724 [ Show all ]
Inchi Key	DOSJTEVSWNHNRS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H29N3O5/c1-19-13-14-23(30-24(31)16-29-27(33)35-18-20-9-5-3-6-10-20)22(15-19)26(28-17-25(32)34-2)21-11-7-4-8-12-21/h3-15,26,28H,16-18H2,1-2H3,(H,29,33)(H,30,31)
PubChem CID	3527724
ChEMBL	CHEMBL1573548
IUPHAR	N/A
BindingDB	62087
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

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
65282	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
65280	Melanin-concentrating hormone receptor 1	Q99705	MCHR1	Homo sapiens (Human)	422
65281	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371
65279	Neuropeptides B/W receptor type 1	P48145	NPBWR1	Homo sapiens (Human)	328

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