Bioactive Compound Details
| BioID | bio199951 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL65298 |
| Molecular Formula | C7H11NO3 |
| Molecular Weight | 157.17 |
| Molecular Weight (Monoisotopic) | 157.0739 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-Isocyanato-Pentanoic Acid Methyl Ester |
| Smiles | CCCC(N=C=O)C(=O)OC |
| Inchi | InChI=1S/C7H11NO3/c1-3-4-6(8-5-9)7(10)11-2/h6H,3-4H2,1-2H3 |
| Inchi Key | IJOFPOYAZZHXCK-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 0.19 |
| Records Key | ['12'] |
| Records Name | ['2-Isocyanato-pentanoic acid methyl ester'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
