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Name | SCHEMBL17472597 |
---|---|
Molecular formula | C27H27N3O5S2 |
IUPAC name | 2-[[6-[[[4-(3-ethoxyphenyl)phenyl]methyl-thiophen-2-ylsulfonylamino]methyl]pyridin-2-yl]amino]acetic acid |
Molecular weight | 537.649 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 4.9 |
Synonyms | US9676720, Example 11 BDBM179998 |
Inchi Key | AAOOYKUXLKXSOL-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H27N3O5S2/c1-2-35-24-8-3-6-22(16-24)21-13-11-20(12-14-21)18-30(37(33,34)27-10-5-15-36-27)19-23-7-4-9-25(29-23)28-17-26(31)32/h3-16H,2,17-19H2,1H3,(H,28,29)(H,31,32) |
PubChem CID | 86295529 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 179998 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
555479 | Prostaglandin E2 receptor EP2 subtype | P43116 | PTGER2 | Homo sapiens (Human) | 358 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417