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Name | AC1LR8M9 |
---|---|
Molecular formula | C22H14N2O7 |
IUPAC name | 2-methyl-3-[5-(3-nitrophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid |
Molecular weight | 418.361 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 3.7 |
Synonyms | CHEMBL593024 2-methyl-3-[5-(3-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzoic acid Oprea1_169871 AKOS003244262 MCULE-5678913550 [ Show all ] |
Inchi Key | SCILHGCBKZJSAK-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H14N2O7/c1-12-16(22(27)28)6-3-7-19(12)23-20(25)17-9-8-15(11-18(17)21(23)26)31-14-5-2-4-13(10-14)24(29)30/h2-11H,1H3,(H,27,28) |
PubChem CID | 1364351 |
ChEMBL | CHEMBL593024 |
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 |
---|---|---|---|---|---|
310816 | Lysophosphatidic acid receptor 5 | Q9H1C0 | LPAR5 | Homo sapiens (Human) | 372 |
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