Bioactive Compound Details
| BioID | bio2338 |
|---|---|
| Name | LOTRAFIBAN HYDROCHLORIDE |
| ChEMBL ID | CHEMBL2106651 |
| Molecular Formula | C23H33ClN4O4 |
| Molecular Weight | 464.99 |
| Molecular Weight (Monoisotopic) | 428.2424 |
| Type | Small molecule |
| Max Phase | Unknown |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | LOTRAFIBAN HCL|LOTRAFIBAN HYDROCHLORIDE|SB-214857-A |
| Smiles | CN1Cc2cc(C(=O)N3CCC(C4CCNCC4)CC3)ccc2N[C@@H](CC(=O)O)C1=O.Cl |
| Inchi | InChI=1S/C23H32N4O4.ClH/c1-26-14-18-12-17(2-3-19(18)25-20(23(26)31)13-21(28)29)22(30)27-10-6-16(7-11-27)15-4-8-24-9-5-15;/h2-3,12,15-16,20,24-25H,4-11,13-14H2,1H3,(H,28,29);1H/t20-;/m0./s1 |
| Inchi Key | ZTHSAEXVSBEBHE-BDQAORGHSA-N |
| Molecular Species | ZWITTERION |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -0.24 |
| Records Key | ['LOTRAFIBAN HYDROCHLORIDE'] |
| Records Name | ['LOTRAFIBAN HYDROCHLORIDE'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
