Bioactive Compound Details
| BioID | bio198520 |
|---|---|
| Name | AXISTATIN 2 |
| ChEMBL ID | CHEMBL2337300 |
| Molecular Formula | C26H41N5O |
| Molecular Weight | 439.65 |
| Molecular Weight (Monoisotopic) | 439.3311 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Axistatin 2 |
| Smiles | CNc1ncnc(N)c1N(C=O)C/C=C(\C)CC[C@@]1(C)[C@H](C)CC[C@@]2(C)C(C)=CCC[C@H]12 |
| Inchi | InChI=1S/C26H41N5O/c1-18(12-15-31(17-32)22-23(27)29-16-30-24(22)28-6)10-13-25(4)20(3)11-14-26(5)19(2)8-7-9-21(25)26/h8,12,16-17,20-21H,7,9-11,13-15H2,1-6H3,(H3,27,28,29,30)/b18-12+/t20-,21-,25+,26+/m1/s1 |
| Inchi Key | SGKIRYPVJGUSPZ-FGOPRVDBSA-N |
| Molecular Species | NEUTRAL |
| Targets | 17.0 |
| Bioactivities | 17.0 |
| Np Likeness Score | 2.34 |
| Records Key | ['2'] |
| Records Name | ['Axistatin 2'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
