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Name | CHEMBL260674 |
---|---|
Molecular formula | C20H14ClFN2O5 |
IUPAC name | 2-[(3R)-5-chloro-1'-[(2-fluorophenyl)methyl]-2,2',5'-trioxospiro[indole-3,3'-pyrrolidine]-1-yl]acetic acid |
Molecular weight | 416.789 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 1.8 |
Synonyms | ZINC14976624 BDBM21603 SCHEMBL2482377 2-[(3R)-5-chloro-1''-[(2-fluorophenyl)methyl]-1,2-dihydrospiro[indole-3,3''-pyrrolidine]-2,2'',5''-trione]acetic acid Spiro-indolinone analogue, (R)-58 |
Inchi Key | SKLDVYDFQCXARY-HXUWFJFHSA-N |
Inchi ID | InChI=1S/C20H14ClFN2O5/c21-12-5-6-15-13(7-12)20(18(28)23(15)10-17(26)27)8-16(25)24(19(20)29)9-11-3-1-2-4-14(11)22/h1-7H,8-10H2,(H,26,27)/t20-/m1/s1 |
PubChem CID | 24776302 |
ChEMBL | CHEMBL260674 |
IUPHAR | N/A |
BindingDB | 21603 |
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 |
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316571 | Prostaglandin D2 receptor | Q13258 | PTGDR | Homo sapiens (Human) | 359 |
316569 | Prostaglandin D2 receptor 2 | Q9Y5Y4 | PTGDR2 | Homo sapiens (Human) | 395 |
316570 | Prostaglandin D2 receptor 2 | Q9Z2J6 | Ptgdr2 | Mus musculus (Mouse) | 382 |
316568 | Prostaglandin E2 receptor EP2 subtype | P43116 | PTGER2 | Homo sapiens (Human) | 358 |
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