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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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GPCR

Name	Delta-type opioid receptor
Species	Rattus norvegicus (Rat)
Gene	Oprd1
Synonym	opioid receptor OP1 DOR-1 DOR DOPr DOP delta receptor D-OR-1 Opioid receptor A [ Show all ]
Disease	N/A for non-human GPCRs
Length	372
Amino acid sequence	MEPVPSARAELQFSLLANVSDTFPSAFPSASANASGSPGARSASSLALAIAITALYSAVCAVGLLGNVLVMFGIVRYTKLKTATNIYIFNLALADALATSTLPFQSAKYLMETWPFGELLCKAVLSIDYYNMFTSIFTLTMMSVDRYIAVCHPVKALDFRTPAKAKLINICIWVLASGVGVPIMVMAVTQPRDGAVVCTLQFPSPSWYWDTVTKICVFLFAFVVPILIITVCYGLMLLRLRSVRLLSGSKEKDRSLRRITRMVLVVVGAFVVCWAPIHIFVIVWTLVDINRRDPLVVAALHLCIALGYANSSLNPVLYAFLDENFKRCFRQLCRAPCGGQEPGSLRRPRQATARERVTACTPSDGPGGGAAA
UniProt	P33533
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL269
IUPHAR	317
DrugBank	N/A

Ligand

Name	CHEMBL146108
Molecular formula	C25H33N3O3
IUPAC name	(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-tert-butyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
Molecular weight	423.557
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	3.1
Synonyms	BDBM50083165 (S)-2-[(S)-2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-propionyl]-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid tert-butylamide
Inchi Key	ASKBYBNQNYTQNX-VXKWHMMOSA-N
Inchi ID	InChI=1S/C25H33N3O3/c1-15-10-19(29)11-16(2)20(15)13-21(26)24(31)28-14-18-9-7-6-8-17(18)12-22(28)23(30)27-25(3,4)5/h6-11,21-22,29H,12-14,26H2,1-5H3,(H,27,30)/t21-,22-/m0/s1
PubChem CID	10526305
ChEMBL	CHEMBL146108
IUPHAR	N/A
BindingDB	50083165
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	0.43 nM	PMID10585210	BindingDB,ChEMBL
Ki	0.93 nM	PMID10585210	BindingDB,ChEMBL

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