You can:
Name | Cannabinoid receptor 1 |
---|---|
Species | Rattus norvegicus (Rat) |
Gene | Cnr1 |
Synonym | SKR6R Neuronal cannabinoid receptor Central cannabinoid receptor CB1R CB1 receptor [ Show all ] |
Disease | N/A for non-human GPCRs |
Length | 473 |
Amino acid sequence | MKSILDGLADTTFRTITTDLLYVGSNDIQYEDIKGDMASKLGYFPQKFPLTSFRGSPFQEKMTAGDNSPLVPAGDTTNITEFYNKSLSSFKENEENIQCGENFMDMECFMILNPSQQLAIAVLSLTLGTFTVLENLLVLCVILHSRSLRCRPSYHFIGSLAVADLLGSVIFVYSFVDFHVFHRKDSPNVFLFKLGGVTASFTASVGSLFLTAIDRYISIHRPLAYKRIVTRPKAVVAFCLMWTIAIVIAVLPLLGWNCKKLQSVCSDIFPLIDETYLMFWIGVTSVLLLFIVYAYMYILWKAHSHAVRMIQRGTQKSIIIHTSEDGKVQVTRPDQARMDIRLAKTLVLILVVLIICWGPLLAIMVYDVFGKMNKLIKTVFAFCSMLCLLNSTVNPIIYALRSKDLRHAFRSMFPSCEGTAQPLDNSMGDSDCLHKHANNTASMHRAAESCIKSTVKIAKVTMSVSTDTSAEAL |
UniProt | P20272 |
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 | CHEMBL3571 |
IUPHAR | 56 |
DrugBank | N/A |
Name | CHEMBL558725 |
---|---|
Molecular formula | C26H31BrClN3O |
IUPAC name | N-[(2S,3S)-3-(3-bromophenyl)-4-(4-chlorophenyl)butan-2-yl]-6-hexoxypyrimidin-4-amine |
Molecular weight | 516.908 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 8.6 |
Synonyms | BDBM50298070 N-((2S,3S)-3-(3-bromophenyl)-4-(4-chlorophenyl)butan-2-yl)-6-(hexyloxy)pyrimidin-4-amine |
Inchi Key | AFTIRHJLPJTCNM-YADARESESA-N |
Inchi ID | InChI=1S/C26H31BrClN3O/c1-3-4-5-6-14-32-26-17-25(29-18-30-26)31-19(2)24(21-8-7-9-22(27)16-21)15-20-10-12-23(28)13-11-20/h7-13,16-19,24H,3-6,14-15H2,1-2H3,(H,29,30,31)/t19-,24+/m0/s1 |
PubChem CID | 45273781 |
ChEMBL | CHEMBL558725 |
IUPHAR | N/A |
BindingDB | 50298070 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 135.0 nM | PMID19596576 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417