Bioactive Compound Details
| BioID | bio198237 |
|---|---|
| Name | (2-METHYLBENZYLAMINO)METHYLENEDIPHOSPHONIC ACID |
| ChEMBL ID | CHEMBL2251370 |
| Molecular Formula | C9H15NO6P2 |
| Molecular Weight | 295.17 |
| Molecular Weight (Monoisotopic) | 295.0375 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | None |
| Smiles | Cc1ccccc1CNC(P(=O)(O)O)P(=O)(O)O |
| Inchi | InChI=1S/C9H15NO6P2/c1-7-4-2-3-5-8(7)6-10-9(17(11,12)13)18(14,15)16/h2-5,9-10H,6H2,1H3,(H2,11,12,13)(H2,14,15,16) |
| Inchi Key | KAHRAMCKQLEIPS-UHFFFAOYSA-N |
| Molecular Species | ACID |
| Targets | 2.0 |
| Bioactivities | 5.0 |
| Np Likeness Score | -0.39 |
| Records Key | ['BP12', '6'] |
| Records Name | ['(2-methylbenzylamino)methylenediphosphonic acid', '(2-methylbenzylamino)methylenediphosphonic acid'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
