| BioID | bio2069 |
|---|
| Name | XEMILOFIBAN HYDROCHLORIDE |
|---|
| ChEMBL ID | CHEMBL2448116 |
|---|
| Molecular Formula | C18H23ClN4O4 |
|---|
| Molecular Weight | 394.86 |
|---|
| Molecular Weight (Monoisotopic) | 358.1641 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Unknown |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | SC-54684A|XEMILOFIBAN HCL|XEMILOFIBAN HYDROCHLORIDE |
|---|
| Smiles | C#C[C@H](CC(=O)OCC)NC(=O)CCC(=O)Nc1ccc(C(=N)N)cc1.Cl |
|---|
| Inchi | InChI=1S/C18H22N4O4.ClH/c1-3-13(11-17(25)26-4-2)21-15(23)9-10-16(24)22-14-7-5-12(6-8-14)18(19)20;/h1,5-8,13H,4,9-11H2,2H3,(H3,19,20)(H,21,23)(H,22,24);1H/t13-;/m1./s1 |
|---|
| Inchi Key | JTZJXWLQRZUDFJ-BTQNPOSSSA-N |
|---|
| Molecular Species | BASE |
|---|
| Targets | None |
|---|
| Bioactivities | None |
|---|
| Np Likeness Score | -0.52 |
|---|
| Records Key | ['XEMILOFIBAN HYDROCHLORIDE'] |
|---|
| Records Name | ['XEMILOFIBAN HYDROCHLORIDE'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
