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Name | Oxytocin receptor |
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Species | Rattus norvegicus (Rat) |
Gene | Oxtr |
Synonym | OT receptor OT-R OTR |
Disease | N/A for non-human GPCRs |
Length | 388 |
Amino acid sequence | MEGTPAANWSVELDLGSGVPPGEEGNRTAGPPQRNEALARVEVAVLCLILFLALSGNACVLLALRTTRHKHSRLFFFMKHLSIADLVVAVFQVLPQLLWDITFRFYGPDLLCRLVKYLQVVGMFASTYLLLLMSLDRCLAICQPLRSLRRRTDRLAVLGTWLGCLVASAPQVHIFSLREVADGVFDCWAVFIQPWGPKAYVTWITLAVYIVPVIVLAACYGLISFKIWQNLRLKTAAAAAAAEGNDAAGGAGRAALARVSSVKLISKAKIRTVKMTFIIVLAFIVCWTPFFFVQMWSVWDVNAPKEASAFIIAMLLASLNSCCNPWIYMLFTGHLFHELVQRFFCCSARYLKGSRPGETSVSKKSNSSTFVLSRRSSSQRSCSQPSSA |
UniProt | P70536 |
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 | CHEMBL3996 |
IUPHAR | 369 |
DrugBank | N/A |
Name | CHEMBL115277 |
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Molecular formula | C25H28O8 |
IUPAC name | [2-[(1S)-1-acetyloxy-3-methylbutyl]-1-methoxy-8-methyl-12-oxo-10H-benzo[b][1,5]benzodioxocin-6-yl] acetate |
Molecular weight | 456.491 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 0 |
XlogP | 4.4 |
Synonyms | Acetic acid 9-((S)-1-acetoxy-3-methyl-butyl)-8-methoxy-3-methyl-7-oxo-5H,7H-6,12-dioxa-dibenzo[a,d]cycloocten-1-yl ester BDBM50281513 |
Inchi Key | CKZIYLVZONHALO-FQEVSTJZSA-N |
Inchi ID | InChI=1S/C25H28O8/c1-13(2)9-20(31-15(4)26)18-7-8-19-22(24(18)29-6)25(28)30-12-17-10-14(3)11-21(23(17)33-19)32-16(5)27/h7-8,10-11,13,20H,9,12H2,1-6H3/t20-/m0/s1 |
PubChem CID | 44342185 |
ChEMBL | CHEMBL115277 |
IUPHAR | N/A |
BindingDB | 50281513 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 5000.0 nM | , Bioorg. Med. Chem. Lett., (1993) 3:2:337 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417