| BioID | bio2987 |
|---|
| Name | ASAPIPRANT |
|---|
| ChEMBL ID | CHEMBL3545043 |
|---|
| Molecular Formula | C24H27N3O7S |
|---|
| Molecular Weight | 501.56 |
|---|
| Molecular Weight (Monoisotopic) | 501.157 |
|---|
| Type | Small molecule |
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| Max Phase | Phase 3 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | ASAPIPRANT|Asapiprant|BGE 175|BGE-175|BGE175|S-555739 |
|---|
| Smiles | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4ncco4)c(OCC(=O)O)c3)CC2)cc1 |
|---|
| Inchi | InChI=1S/C24H27N3O7S/c1-17(2)34-19-4-6-20(7-5-19)35(30,31)27-12-10-26(11-13-27)18-3-8-21(24-25-9-14-32-24)22(15-18)33-16-23(28)29/h3-9,14-15,17H,10-13,16H2,1-2H3,(H,28,29) |
|---|
| Inchi Key | ZMZNWNTZRWXTJU-UHFFFAOYSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 10.0 |
|---|
| Bioactivities | 26.0 |
|---|
| Np Likeness Score | -1.43 |
|---|
| Records Key | ['ASAPIPRANT', 'II-74'] |
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| Records Name | ['ASAPIPRANT', '2-(5-(4-(4-isopropoxyphenylsulfonyl)piperazin-1-yl)-2-(oxazol-2-yl)phenoxy)acetic acid'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
