| BioID | bio197980 |
|---|
| Name | HYMENIALDISINE 2 |
|---|
| ChEMBL ID | CHEMBL398498 |
|---|
| Molecular Formula | C15H14BrN5O4 |
|---|
| Molecular Weight | 408.21 |
|---|
| Molecular Weight (Monoisotopic) | 407.0229 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | Hymenialdisine 2 |
|---|
| Smiles | CC(=O)NC1=NC(=O)/C(=C2\CCNC(=O)c3c2cc(Br)n3C(C)=O)N1 |
|---|
| Inchi | InChI=1S/C15H14BrN5O4/c1-6(22)18-15-19-11(13(24)20-15)8-3-4-17-14(25)12-9(8)5-10(16)21(12)7(2)23/h5H,3-4H2,1-2H3,(H,17,25)(H2,18,19,20,22,24)/b11-8- |
|---|
| Inchi Key | VAMZZBTXBZOVSP-FLIBITNWSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 2.0 |
|---|
| Np Likeness Score | 0.16 |
|---|
| Records Key | ['8, Hymenialdisine 2', '8'] |
|---|
| Records Name | ['(Z)-N-(5-(1-acetyl-2-bromo-8-oxo-5,6,7,8-tetrahydropyrrolo[2,3-c]azepin-4(1H)-ylidene)-4-oxo-4,5-dihydro-1H-imidazol-2-yl)acetamide', 'Hymenialdisine 2'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
