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Name | AC1LRAEE |
---|---|
Molecular formula | C20H13N3O5 |
IUPAC name | 5-(3-nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione |
Molecular weight | 375.34 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 2.7 |
Synonyms | 5-(3-nitrophenoxy)-2-(pyridin-3-ylmethyl)-1H-isoindole-1,3(2H)-dione MCULE-5764327349 STK032260 5-(3-nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione MolPort-001-620-641 [ Show all ] |
Inchi Key | IGPKNBILKWYGSI-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H13N3O5/c24-19-17-7-6-16(28-15-5-1-4-14(9-15)23(26)27)10-18(17)20(25)22(19)12-13-3-2-8-21-11-13/h1-11H,12H2 |
PubChem CID | 1365291 |
ChEMBL | CHEMBL595395 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
132753 | Lysophosphatidic acid receptor 5 | Q9H1C0 | LPAR5 | Homo sapiens (Human) | 372 |
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