You can:
Name | Cysteinyl leukotriene receptor 2 |
---|---|
Species | Homo sapiens (Human) |
Gene | CYSLTR2 |
Synonym | CysLTR2 CysLT2 receptor LTC4 HPN321 hGPCR21 [ Show all ] |
Disease | Unspecified Asthma |
Length | 346 |
Amino acid sequence | MERKFMSLQPSISVSEMEPNGTFSNNNSRNCTIENFKREFFPIVYLIIFFWGVLGNGLSIYVFLQPYKKSTSVNVFMLNLAISDLLFISTLPFRADYYLRGSNWIFGDLACRIMSYSLYVNMYSSIYFLTVLSVVRFLAMVHPFRLLHVTSIRSAWILCGIIWILIMASSIMLLDSGSEQNGSVTSCLELNLYKIAKLQTMNYIALVVGCLLPFFTLSICYLLIIRVLLKVEVPESGLRVSHRKALTTIIITLIIFFLCFLPYHTLRTVHLTTWKVGLCKDRLHKALVITLALAAANACFNPLLYYFAGENFKDRLKSALRKGHPQKAKTKCVFPVSVWLRKETRV |
UniProt | Q9NS75 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q9NS75 |
3D structure model | This predicted structure model is from GPCR-EXP Q9NS75. |
BioLiP | N/A |
Therapeutic Target Database | T74238 |
ChEMBL | CHEMBL4330 |
IUPHAR | 270 |
DrugBank | BE0000099 |
Name | CHEMBL3597528 |
---|---|
Molecular formula | C33H35NO5 |
IUPAC name | 4-[1-(carboxymethyl)-2-methyl-7-[(E)-2-[4-(4-phenylbutoxy)phenyl]ethenyl]indol-3-yl]butanoic acid |
Molecular weight | 525.645 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 7.1 |
Synonyms | 4-(1-Carboxymethyl-2-methyl-7-(4-(4-phenylbutyloxy)styryl)-1H-indole-3-yl)butyric acid BDBM50104865 |
Inchi Key | OSDCTRXECXZIED-KNTRCKAVSA-N |
Inchi ID | InChI=1S/C33H35NO5/c1-24-29(13-8-15-31(35)36)30-14-7-12-27(33(30)34(24)23-32(37)38)19-16-26-17-20-28(21-18-26)39-22-6-5-11-25-9-3-2-4-10-25/h2-4,7,9-10,12,14,16-21H,5-6,8,11,13,15,22-23H2,1H3,(H,35,36)(H,37,38)/b19-16+ |
PubChem CID | 122183685 |
ChEMBL | CHEMBL3597528 |
IUPHAR | N/A |
BindingDB | 50104865 |
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 | 4.7 nM | PMID26200813 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417