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Name | 4-(methylamino)-3-nitrobenzoic acid |
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Molecular formula | C8H8N2O4 |
IUPAC name | 4-(methylamino)-3-nitrobenzoic acid |
Molecular weight | 196.162 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 1.9 |
Synonyms | CHEMBL237731 FT-0647367 MCULE-9249468232 SC-44956 4-(methylamino)-3-nitro-benzoic acid [ Show all ] |
Inchi Key | KSMLIIWEQBYUKA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C8H8N2O4/c1-9-6-3-2-5(8(11)12)4-7(6)10(13)14/h2-4,9H,1H3,(H,11,12) |
PubChem CID | 283475 |
ChEMBL | CHEMBL237731 |
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 |
---|---|---|---|---|---|
177143 | Hydroxycarboxylic acid receptor 3 | P49019 | HCAR3 | Homo sapiens (Human) | 387 |
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