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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	d[Arg4,Dab8]VP
Molecular formula	C45H64N14O11S2
IUPAC name	(2S)-N-[(2S)-4-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxobutan-2-yl]-1-[(4R,7S,10S,13S,16S)-7-(2-amino-2-oxoethyl)-13-benzyl-10-[3-(diaminomethylideneamino)propyl]-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide
Molecular weight	1041.21
Hydrogen bond acceptor	15
Hydrogen bond donor	13
XlogP	-3.8
Synonyms	BDBM50205296 D0UK0O CHEMBL385739
Inchi Key	JTUSVVYBCYZYRH-NXBWRCJVSA-N
Inchi ID	InChI=1S/C45H64N14O11S2/c46-16-14-29(38(64)52-23-36(48)62)55-43(69)34-9-5-18-59(34)44(70)33-24-72-71-19-15-37(63)53-30(21-26-10-12-27(60)13-11-26)40(66)56-31(20-25-6-2-1-3-7-25)41(67)54-28(8-4-17-51-45(49)50)39(65)57-32(22-35(47)61)42(68)58-33/h1-3,6-7,10-13,28-34,60H,4-5,8-9,14-24,46H2,(H2,47,61)(H2,48,62)(H,52,64)(H,53,63)(H,54,67)(H,55,69)(H,56,66)(H,57,65)(H,58,68)(H4,49,50,51)/t28-,29-,30-,31-,32-,33-,34-/m0/s1
PubChem CID	16109443
ChEMBL	CHEMBL385739
IUPHAR	N/A
BindingDB	50205296
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
159803	Oxytocin receptor	P70536	Oxtr	Rattus norvegicus (Rat)	388
159804	Oxytocin receptor	P30559	OXTR	Homo sapiens (Human)	389
159802	Vasopressin V1a receptor	P30560	Avpr1a	Rattus norvegicus (Rat)	424
159805	Vasopressin V1b receptor	P48974	Avpr1b	Rattus norvegicus (Rat)	425
159806	Vasopressin V2 receptor	Q00788	Avpr2	Rattus norvegicus (Rat)	371

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