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Name | Kappa-type opioid receptor |
---|---|
Species | Mus musculus (Mouse) |
Gene | Oprk1 |
Synonym | MSL-1 KOR-1 KOPr KOP Kappa receptor [ Show all ] |
Disease | N/A for non-human GPCRs |
Length | 380 |
Amino acid sequence | MESPIQIFRGDPGPTCSPSACLLPNSSSWFPNWAESDSNGSVGSEDQQLESAHISPAIPVIITAVYSVVFVVGLVGNSLVMFVIIRYTKMKTATNIYIFNLALADALVTTTMPFQSAVYLMNSWPFGDVLCKIVISIDYYNMFTSIFTLTMMSVDRYIAVCHPVKALDFRTPLKAKIINICIWLLASSVGISAIVLGGTKVREDVDVIECSLQFPDDEYSWWDLFMKICVFVFAFVIPVLIIIVCYTLMILRLKSVRLLSGSREKDRNLRRITKLVLVVVAVFIICWTPIHIFILVEALGSTSHSTAALSSYYFCIALGYTNSSLNPVLYAFLDENFKRCFRDFCFPIKMRMERQSTNRVRNTVQDPASMRDVGGMNKPV |
UniProt | P33534 |
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 | CHEMBL4329 |
IUPHAR | 318 |
DrugBank | N/A |
Name | CHEMBL148588 |
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Molecular formula | C28H39N9O6 |
IUPAC name | (2S)-2-[[(2S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-2-(diaminomethylideneamino)-3-(3-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-phenylpropanoyl]amino]propanoic acid |
Molecular weight | 597.677 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 9 |
XlogP | -0.3 |
Synonyms | 2-(2-{5-Guanidino-2-[2-guanidino-3-(3-hydroxy-phenyl)-propionylamino]-pentanoylamino}-3-phenyl-propionylamino)-propionic acid BDBM50120875 |
Inchi Key | DVUKUEIZDQXDFH-KPQYALRZSA-N |
Inchi ID | InChI=1S/C28H39N9O6/c1-16(26(42)43)34-24(40)21(14-17-7-3-2-4-8-17)36-23(39)20(11-6-12-33-27(29)30)35-25(41)22(37-28(31)32)15-18-9-5-10-19(38)13-18/h2-5,7-10,13,16,20-22,38H,6,11-12,14-15H2,1H3,(H,34,40)(H,35,41)(H,36,39)(H,42,43)(H4,29,30,33)(H4,31,32,37)/t16-,20-,21-,22-/m0/s1 |
PubChem CID | 44365001 |
ChEMBL | CHEMBL148588 |
IUPHAR | N/A |
BindingDB | 50120875 |
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 | <1000.0 nM | PMID12408719 | BindingDB,ChEMBL |
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