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Name | Delta-type opioid receptor |
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Species | Mus musculus (Mouse) |
Gene | Oprd1 |
Synonym | OP1 MSL-2 K56 DOR-1 DOR [ Show all ] |
Disease | N/A for non-human GPCRs |
Length | 372 |
Amino acid sequence | MELVPSARAELQSSPLVNLSDAFPSAFPSAGANASGSPGARSASSLALAIAITALYSAVCAVGLLGNVLVMFGIVRYTKLKTATNIYIFNLALADALATSTLPFQSAKYLMETWPFGELLCKAVLSIDYYNMFTSIFTLTMMSVDRYIAVCHPVKALDFRTPAKAKLINICIWVLASGVGVPIMVMAVTQPRDGAVVCMLQFPSPSWYWDTVTKICVFLFAFVVPILIITVCYGLMLLRLRSVRLLSGSKEKDRSLRRITRMVLVVVGAFVVCWAPIHIFVIVWTLVDINRRDPLVVAALHLCIALGYANSSLNPVLYAFLDENFKRCFRQLCRTPCGRQEPGSLRRPRQATTRERVTACTPSDGPGGGAAA |
UniProt | P32300 |
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 | CHEMBL3222 |
IUPHAR | 317 |
DrugBank | N/A |
Name | ICI 174,864 |
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Molecular formula | C38H53N5O7 |
IUPAC name | (2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-[bis(prop-2-enyl)amino]-3-(4-hydroxyphenyl)propanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid |
Molecular weight | 691.87 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 6 |
XlogP | 2.8 |
Synonyms | 2-[2-(2-{2-[2-Diallylamino-3-(4-hydroxy-phenyl)-propionylamino]-2-methyl-propionylamino}-2-methyl-propionylamino)-3-phenyl-propionylamino]-4-methyl-pentanoic acid Ici 174865 N-(N-(N-(N-(N,N-di-2-Propenyl-L-tyrosyl)-2-methylalanyl)-2-methylalanyl)-L-phenylalanyl)-L-leucine BDBM50006946 L-Leucine,N,N-di-2-propen-1-yl-L-tyrosyl-2-methylalanyl-L-phenylalanyl- [ Show all ] |
Inchi Key | XUWLAGNFLUARAN-CHQNGUEUSA-N |
Inchi ID | InChI=1S/C38H53N5O7/c1-9-20-43(21-10-2)31(24-27-16-18-28(44)19-17-27)33(46)41-38(7,8)36(50)42-37(5,6)35(49)40-29(23-26-14-12-11-13-15-26)32(45)39-30(34(47)48)22-25(3)4/h9-19,25,29-31,44H,1-2,20-24H2,3-8H3,(H,39,45)(H,40,49)(H,41,46)(H,42,50)(H,47,48)/t29-,30-,31-/m0/s1 |
PubChem CID | 44149909 |
ChEMBL | CHEMBL47545 |
IUPHAR | N/A |
BindingDB | 50006946 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 703.0 nM | PMID11052799 | BindingDB,ChEMBL |
IC50 | 3250.0 nM | PMID8035418 | BindingDB |
IC50 ratio | 15.6 - | PMID3041000, PMID2160538 | ChEMBL |
IC50 ratio | 147.0 - | PMID3041000 | ChEMBL |
Ke | 69.0 nM | PMID2160538, PMID1648136 | ChEMBL |
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