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Name | 4-(cyclopentylamino)-3-nitrobenzoic acid |
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Molecular formula | C12H14N2O4 |
IUPAC name | 4-(cyclopentylamino)-3-nitrobenzoic acid |
Molecular weight | 250.254 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 3.1 |
Synonyms | 4-cyclopentylamino-3-nitrobenzoicacid CTK5I2634 AKOS000214638 ZINC13277061 4-CYCLOPENTYLAMINO-3-NITRO-BENZOIC ACID [ Show all ] |
Inchi Key | CNIQZZBIZUJGQB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C12H14N2O4/c15-12(16)8-5-6-10(11(7-8)14(17)18)13-9-3-1-2-4-9/h5-7,9,13H,1-4H2,(H,15,16) |
PubChem CID | 11565047 |
ChEMBL | CHEMBL392830 |
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 |
---|---|---|---|---|---|
46066 | Hydroxycarboxylic acid receptor 3 | P49019 | HCAR3 | Homo sapiens (Human) | 387 |
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