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Name | Mu-type opioid receptor |
---|---|
Species | Cavia porcellus (Guinea pig) |
Gene | OPRM1 |
Synonym | M-OR-1 MOR-1 |
Disease | N/A for non-human GPCRs |
Length | 98 |
Amino acid sequence | YTKMKTATNIYIFNLALADALATSTLPFQSVNYLMGTWPFGTILCKIVISIDYYNMFTSIFTLCTMSVDRYIAVCHPVKALDFRTPRNAKTVNVCNWI |
UniProt | P97266 |
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 | CHEMBL4354 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL2370497 |
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Molecular formula | C63H107N23O11 |
IUPAC name | (2S)-1-[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]hexyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]-N-[(2S)-1,6-diamino-1-oxohexan-2-yl]pyrrolidine-2-carboxamide |
Molecular weight | 1362.7 |
Hydrogen bond acceptor | 18 |
Hydrogen bond donor | 20 |
XlogP | -4.1 |
Synonyms | BDBM50453782 |
Inchi Key | ANJXEKUKGCQXNN-WPVLUZQDSA-N |
Inchi ID | InChI=1S/C63H107N23O11/c1-3-38(2)52(59(96)84-47(21-13-31-76-63(72)73)60(97)86-32-14-22-49(86)58(95)82-44(53(67)90)18-8-10-28-65)85-56(93)46(20-12-30-75-62(70)71)83-55(92)45(19-11-29-74-61(68)69)77-35-41(17-7-9-27-64)80-57(94)48(34-39-15-5-4-6-16-39)81-51(89)37-78-50(88)36-79-54(91)43(66)33-40-23-25-42(87)26-24-40/h4-6,15-16,23-26,38,41,43-49,52,77,87H,3,7-14,17-22,27-37,64-66H2,1-2H3,(H2,67,90)(H,78,88)(H,79,91)(H,80,94)(H,81,89)(H,82,95)(H,83,92)(H,84,96)(H,85,93)(H4,68,69,74)(H4,70,71,75)(H4,72,73,76)/t38-,41-,43-,44-,45-,46-,47-,48-,49-,52-/m0/s1 |
PubChem CID | 73356135 |
ChEMBL | CHEMBL2370497 |
IUPHAR | N/A |
BindingDB | 50453782 |
DrugBank | N/A |
Structure | |
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. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 9.0 nM | PMID7658433 | BindingDB,ChEMBL |
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