| BioID | bio3040 |
|---|
| Name | NIPEROTIDINE |
|---|
| ChEMBL ID | CHEMBL4297186 |
|---|
| Molecular Formula | C20H26N4O5S |
|---|
| Molecular Weight | 434.52 |
|---|
| Molecular Weight (Monoisotopic) | 434.1624 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | NIPEROTIDINA|NIPEROTIDINE |
|---|
| Smiles | CN(C)Cc1ccc(CSCCNC(=C[N+](=O)[O-])NCc2ccc3c(c2)OCO3)o1 |
|---|
| Inchi | InChI=1S/C20H26N4O5S/c1-23(2)11-16-4-5-17(29-16)13-30-8-7-21-20(12-24(25)26)22-10-15-3-6-18-19(9-15)28-14-27-18/h3-6,9,12,21-22H,7-8,10-11,13-14H2,1-2H3 |
|---|
| Inchi Key | HXRSXEDVVARPHP-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | None |
|---|
| Bioactivities | None |
|---|
| Np Likeness Score | -1.05 |
|---|
| Records Key | ['NIPEROTIDINE', 'NIPEROTIDINE'] |
|---|
| Records Name | ['NIPEROTIDINE', 'NIPEROTIDINE'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
