| BioID | bio2767 |
|---|
| Name | OMIDENEPAG |
|---|
| ChEMBL ID | CHEMBL3707245 |
|---|
| Molecular Formula | C23H22N6O4S |
|---|
| Molecular Weight | 478.53 |
|---|
| Molecular Weight (Monoisotopic) | 478.1423 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | OMIDENEPAG|UR-7276 |
|---|
| Smiles | O=C(O)CNc1cccc(CN(Cc2ccc(-n3cccn3)cc2)S(=O)(=O)c2cccnc2)n1 |
|---|
| Inchi | InChI=1S/C23H22N6O4S/c30-23(31)15-25-22-6-1-4-19(27-22)17-28(34(32,33)21-5-2-11-24-14-21)16-18-7-9-20(10-8-18)29-13-3-12-26-29/h1-14H,15-17H2,(H,25,27)(H,30,31) |
|---|
| Inchi Key | YHGSTSNEOJUIRN-UHFFFAOYSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 13.0 |
|---|
| Bioactivities | 21.0 |
|---|
| Np Likeness Score | -2.21 |
|---|
| Records Key | ['13ax; OMD', 'OMIDENEPAG', 'OMIDENEPAG', 'OMD', 'OMIDENEPAG'] |
|---|
| Records Name | ['(6-((4-(pyrazol-1-yl)benzyl)(pyridin-3-ylsulfonyl)-aminomethyl)pyridin-2-ylamino)acetic acid; Omidenepag', 'OMIDENEPAG', 'OMIDENEPAG', 'Omidenepag', 'OMIDENEPAG'] |
|---|
| Withdrawn Flag | False |
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| Orphan | 0 |
|---|
