You can:
Name | CHEMBL2110359 |
---|---|
Molecular formula | C31H41NO5 |
IUPAC name | (Z)-6-[(1R,2S,5R)-2-(azepan-1-yl)-5-[[4-[2-(hydroxymethyl)phenyl]phenyl]methoxy]cyclopentyl]oxyhex-4-enoic acid |
Molecular weight | 507.671 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 2.1 |
Synonyms | SCHEMBL9775014 BDBM50391297 GR-70067 |
Inchi Key | KCLYPNKWGQYJSE-JCOFVJCZSA-N |
Inchi ID | InChI=1S/C31H41NO5/c33-22-26-10-5-6-11-27(26)25-15-13-24(14-16-25)23-37-29-18-17-28(32-19-7-1-2-8-20-32)31(29)36-21-9-3-4-12-30(34)35/h3,5-6,9-11,13-16,28-29,31,33H,1-2,4,7-8,12,17-23H2,(H,34,35)/b9-3-/t28-,29+,31+/m0/s1 |
PubChem CID | 14371756 |
ChEMBL | CHEMBL2110359 |
IUPHAR | N/A |
BindingDB | 50391297 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
165890 | Thromboxane A2 receptor | P34978 | Tbxa2r | Rattus norvegicus (Rat) | 341 |
165891 | Thromboxane A2 receptor | P21731 | TBXA2R | Homo sapiens (Human) | 343 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417