Bioactive Compound Details
| BioID | bio198726 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL239750 |
| Molecular Formula | C9H18N2O2 |
| Molecular Weight | 186.25 |
| Molecular Weight (Monoisotopic) | 186.1368 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-Isopropylpentanoyl Urea |
| Smiles | CCCC(C(=O)NC(N)=O)C(C)C |
| Inchi | InChI=1S/C9H18N2O2/c1-4-5-7(6(2)3)8(12)11-9(10)13/h6-7H,4-5H2,1-3H3,(H3,10,11,12,13) |
| Inchi Key | SNNSWPZZBCWAHA-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 3.0 |
| Bioactivities | 29.0 |
| Np Likeness Score | -0.21 |
| Records Key | ['31', '18, (R,S)-PIU'] |
| Records Name | ['1-(2-Isopropylpentanoyl)urea', '2-isopropylpentanoyl urea'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
