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Name | CHEMBL1641809 |
---|---|
Molecular formula | C20H19ClFN3O4S |
IUPAC name | 2-[(8R)-2-chloro-8-[(4-fluorophenyl)sulfonyl-methylamino]-6,7,8,9-tetrahydropyrido[3,2-b]indolizin-5-yl]acetic acid |
Molecular weight | 451.897 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 3.1 |
Synonyms | (R)-2-(2-chloro-8-(4-fluoro-N-methylphenylsulfonamido)-6,7,8,9-tetrahydropyrido[3,2-b]indolizin-5-yl)acetic acid BDBM50333495 |
Inchi Key | BGWMCYCHLWPGRV-CYBMUJFWSA-N |
Inchi ID | InChI=1S/C20H19ClFN3O4S/c1-24(30(28,29)14-5-2-12(22)3-6-14)13-4-8-17-16(10-19(26)27)15-7-9-18(21)23-20(15)25(17)11-13/h2-3,5-7,9,13H,4,8,10-11H2,1H3,(H,26,27)/t13-/m1/s1 |
PubChem CID | 53321785 |
ChEMBL | CHEMBL1641809 |
IUPHAR | N/A |
BindingDB | 50333495 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
23483 | Prostaglandin D2 receptor | Q13258 | PTGDR | Homo sapiens (Human) | 359 |
23482 | Prostaglandin D2 receptor 2 | Q9Y5Y4 | PTGDR2 | Homo sapiens (Human) | 395 |
23484 | Thromboxane A2 receptor | P21731 | TBXA2R | Homo sapiens (Human) | 343 |
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