| BioID | bio3038 |
|---|
| Name | TEMOPORFIN |
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| ChEMBL ID | CHEMBL383675 |
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| Molecular Formula | C44H32N4O4 |
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| Molecular Weight | 680.76 |
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| Molecular Weight (Monoisotopic) | 680.2424 |
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| Type | Small molecule |
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| Max Phase | Phase 4 |
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| Target ID | Tar12 |
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| Target Name | Toll-like receptor 9 (TLR9) |
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| Synonyms | EF-9|EF9|Foscan|MTHPC|TEMOPORFIN|TEMOPORFINA|TEMOPORFINE |
|---|
| Smiles | Oc1cccc(-c2c3nc(c(-c4cccc(O)c4)c4ccc([nH]4)c(-c4cccc(O)c4)c4ccc([nH]4)c(-c4cccc(O)c4)c4nc2CC4)C=C3)c1 |
|---|
| Inchi | InChI=1S/C44H32N4O4/c49-29-9-1-5-25(21-29)41-33-13-15-35(45-33)42(26-6-2-10-30(50)22-26)37-17-19-39(47-37)44(28-8-4-12-32(52)24-28)40-20-18-38(48-40)43(36-16-14-34(41)46-36)27-7-3-11-31(51)23-27/h1-17,19,21-24,45-46,49-52H,18,20H2/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40- |
|---|
| Inchi Key | KSXLETNRCMCRAQ-LWQDQPMZSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | None |
|---|
| Bioactivities | None |
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| Np Likeness Score | 0.15 |
|---|
| Records Key | ['TEMOPORFIN', 'TEMOPORFIN', 'TEMOPORFIN', 'TEMOPORFIN', 'TEMOPORFIN'] |
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| Records Name | ['TEMOPORFIN', 'TEMOPORFIN', 'TEMOPORFIN', 'TEMOPORFIN', 'TEMOPORFIN'] |
|---|
| Withdrawn Flag | False |
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| Orphan | 0 |
|---|
