Bioactive Compound Details
| BioID | bio199175 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL1090140 |
| Molecular Formula | C14H21N2O4PS |
| Molecular Weight | 344.37 |
| Molecular Weight (Monoisotopic) | 344.096 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 1-Aminobutyl(2-(Methoxycarbonyl)Benzylcarbamothioyl)Phosphinic Acid |
| Smiles | CCCC(N)P(=O)(O)C(=S)NCc1ccccc1C(=O)OC |
| Inchi | InChI=1S/C14H21N2O4PS/c1-3-6-12(15)21(18,19)14(22)16-9-10-7-4-5-8-11(10)13(17)20-2/h4-5,7-8,12H,3,6,9,15H2,1-2H3,(H,16,22)(H,18,19) |
| Inchi Key | SAOFAZQPWFNPRB-UHFFFAOYSA-N |
| Molecular Species | ZWITTERION |
| Targets | 3.0 |
| Bioactivities | 3.0 |
| Np Likeness Score | -0.37 |
| Records Key | ['13'] |
| Records Name | ['1-aminobutyl(2-(methoxycarbonyl)benzylcarbamothioyl)phosphinic acid'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
