| BioID | bio200061 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL1951921 |
|---|
| Molecular Formula | C26H28N4O8 |
|---|
| Molecular Weight | 524.53 |
|---|
| Molecular Weight (Monoisotopic) | 524.1907 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 1,8-Bis[2-(Sacrocine Methyl Ester)Acetamido]Anthraquinone |
|---|
| Smiles | COC(=O)CN(C)CC(=O)Nc1cccc2c1C(=O)c1c(NC(=O)CN(C)CC(=O)OC)cccc1C2=O |
|---|
| Inchi | InChI=1S/C26H28N4O8/c1-29(13-21(33)37-3)11-19(31)27-17-9-5-7-15-23(17)26(36)24-16(25(15)35)8-6-10-18(24)28-20(32)12-30(2)14-22(34)38-4/h5-10H,11-14H2,1-4H3,(H,27,31)(H,28,32) |
|---|
| Inchi Key | UABYHINUAQCLKX-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 6.0 |
|---|
| Np Likeness Score | -0.56 |
|---|
| Records Key | ['3k'] |
|---|
| Records Name | ['1,8-Bis[2-(sacrocine methyl ester)acetamido]anthraquinone'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
