Bioactive Compound Details
| BioID | bio197153 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL550962 |
| Molecular Formula | C28H33FN2O4 |
| Molecular Weight | 480.58 |
| Molecular Weight (Monoisotopic) | 480.2424 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-F-Diazepinomicin |
| Smiles | CC(C)=CCC/C(C)=C/CC/C(C)=C/CN1C(=O)c2cc(F)cc(O)c2Nc2c(O)cc(O)cc21 |
| Inchi | InChI=1S/C28H33FN2O4/c1-17(2)7-5-8-18(3)9-6-10-19(4)11-12-31-23-15-21(32)16-25(34)27(23)30-26-22(28(31)35)13-20(29)14-24(26)33/h7,9,11,13-16,30,32-34H,5-6,8,10,12H2,1-4H3/b18-9+,19-11+ |
| Inchi Key | CGCYKCVCCXLWEB-ZYCAGONGSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 7.0 |
| Np Likeness Score | 1.12 |
| Records Key | ['2'] |
| Records Name | ['2-F-Diazepinomicin'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
