| BioID | bio2555 |
|---|
| Name | PIPRADIMADOL |
|---|
| ChEMBL ID | CHEMBL148635 |
|---|
| Molecular Formula | C24H37ClN2O2 |
|---|
| Molecular Weight | 421.03 |
|---|
| Molecular Weight (Monoisotopic) | 420.2544 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | PIPRADIMADOL|Pipradimadol |
|---|
| Smiles | CN(C(=O)C(C)(C)C1(O)CCN(CCc2ccccc2Cl)CC1)C1CCCCC1 |
|---|
| Inchi | InChI=1S/C24H37ClN2O2/c1-23(2,22(28)26(3)20-10-5-4-6-11-20)24(29)14-17-27(18-15-24)16-13-19-9-7-8-12-21(19)25/h7-9,12,20,29H,4-6,10-11,13-18H2,1-3H3 |
|---|
| Inchi Key | CNIMNQJXZKALLC-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 14.0 |
|---|
| Np Likeness Score | -0.87 |
|---|
| Records Key | ['28', 'PIPRADIMADOL'] |
|---|
| Records Name | ['2-{1-[2-(2-Chloro-phenyl)-ethyl]-4-hydroxy-piperidin-4-yl}-N-cyclohexyl-N-methyl-isobutyramide', 'PIPRADIMADOL'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
