Bioactive Compound Details
| BioID | bio200201 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL468074 |
| Molecular Formula | C15H17NO5 |
| Molecular Weight | 291.3 |
| Molecular Weight (Monoisotopic) | 291.1107 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 3-(2-Carboxycyclohexanecarboxamido)Benzoic Acid |
| Smiles | O=C(O)c1cccc(NC(=O)C2CCCCC2C(=O)O)c1 |
| Inchi | InChI=1S/C15H17NO5/c17-13(11-6-1-2-7-12(11)15(20)21)16-10-5-3-4-9(8-10)14(18)19/h3-5,8,11-12H,1-2,6-7H2,(H,16,17)(H,18,19)(H,20,21) |
| Inchi Key | LHZDDILKQAJPCN-UHFFFAOYSA-N |
| Molecular Species | ACID |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | -0.82 |
| Records Key | ['S9'] |
| Records Name | ['3-(2-carboxycyclohexanecarboxamido)benzoic acid'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
