| BioID | bio2533 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL1215588 |
|---|
| Molecular Formula | C17H35ClN2O4 |
|---|
| Molecular Weight | 366.93 |
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| Molecular Weight (Monoisotopic) | 330.2519 |
|---|
| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | 3-({9-[Butyl(Methyl)]Amino}Nonanoyl(Hydroxy)Amino)Propanoicacid Hydrochloride |
|---|
| Smiles | CCCCN(C)CCCCCCCCC(=O)N(O)CCC(=O)O.Cl |
|---|
| Inchi | InChI=1S/C17H34N2O4.ClH/c1-3-4-13-18(2)14-10-8-6-5-7-9-11-16(20)19(23)15-12-17(21)22;/h23H,3-15H2,1-2H3,(H,21,22);1H |
|---|
| Inchi Key | VJNUIYKPYDEVGR-UHFFFAOYSA-N |
|---|
| Molecular Species | ZWITTERION |
|---|
| Targets | 5.0 |
|---|
| Bioactivities | 5.0 |
|---|
| Np Likeness Score | -0.03 |
|---|
| Records Key | ['14'] |
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| Records Name | ['3-({9-[Butyl(methyl)]amino}nonanoyl(hydroxy)amino)propanoic acid Hydrochloride'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
