| BioID | bio3212 |
|---|
| Name | SOFINICLINE |
|---|
| ChEMBL ID | CHEMBL238465 |
|---|
| Molecular Formula | C10H11Cl2N3 |
|---|
| Molecular Weight | 244.12 |
|---|
| Molecular Weight (Monoisotopic) | 243.033 |
|---|
| Type | Small molecule |
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| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | A-422894.0|ABT-894|SOFINICLINA|SOFINICLINE|Sofinicline |
|---|
| Smiles | Clc1cc(N2C[C@@H]3CN[C@@H]3C2)cnc1Cl |
|---|
| Inchi | InChI=1S/C10H11Cl2N3/c11-8-1-7(3-14-10(8)12)15-4-6-2-13-9(6)5-15/h1,3,6,9,13H,2,4-5H2/t6-,9+/m0/s1 |
|---|
| Inchi Key | MBQYQLWSBRANKQ-IMTBSYHQSA-N |
|---|
| Molecular Species | BASE |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 8.0 |
|---|
| Np Likeness Score | -0.71 |
|---|
| Records Key | ['(1S,5S)-42', 'SOFINICLINE', 'SOFINICLINE'] |
|---|
| Records Name | ['(1S,5S)-3-(5,6-dichloropyridin-3-yl)-3,6-diaza-bicyclo[3.2.0]-heptane', 'SOFINICLINE', 'SOFINICLINE'] |
|---|
| Withdrawn Flag | False |
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| Orphan | 0 |
|---|
