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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	PD157672
Molecular formula	C32H47N5O5
IUPAC name	tert-butyl N-[(2S)-1-[[(2R)-1-[7-(carbamoylamino)heptylamino]-2-methyl-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
Molecular weight	581.758
Hydrogen bond acceptor	5
Hydrogen bond donor	5
XlogP	4.5
Synonyms	{(S)-1-[(R)-1-Methyl-2-phenyl-1-(7-ureido-heptylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester GTPL2125 AC1NSKH5 CHEMBL444832 PD-157672 BDBM50050649 tert-butyl N-[(2S)-1-[[(2R)-1-[7-(carbamoylamino)heptylamino]-2-methyl-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate D04TXE PD157,672 [ Show all ]
Inchi Key	BYVRLIUFCGUMSP-XYFQYJLHSA-N
Inchi ID	InChI=1S/C32H47N5O5/c1-31(2,3)42-30(41)36-26(22-24-16-10-8-11-17-24)27(38)37-32(4,23-25-18-12-9-13-19-25)28(39)34-20-14-6-5-7-15-21-35-29(33)40/h8-13,16-19,26H,5-7,14-15,20-23H2,1-4H3,(H,34,39)(H,36,41)(H,37,38)(H3,33,35,40)/t26-,32+/m0/s1
PubChem CID	5311350
ChEMBL	CHEMBL444832
IUPHAR	2125
BindingDB	50050649
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
36137	Neuromedin-K receptor	P30098	TACR3	Cavia porcellus (Guinea pig)	440
36138	Neuromedin-K receptor	P29371	TACR3	Homo sapiens (Human)	465
36139	Neuromedin-K receptor	P16177	Tacr3	Rattus norvegicus (Rat)	452
36141	Substance-K receptor	P51144	TACR2	Mesocricetus auratus (Golden hamster)	384
36140	Substance-P receptor	P25103	TACR1	Homo sapiens (Human)	407

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