DL-4-Oxalysine dihydrochloride
AlkaPlorer ID: AK010231
Synonym: 'Oxalysine', 'OXALYSINE,DL-4- DIHYDROCHLORIDE'
IUPAC Name: (2S)-2-amino-3-(2-aminoethoxy)propanoic acid
Structure
SMILES: NCCOC[C@H](N)C(=O)O
InChI: InChI=1S/C5H12N2O3/c6-1-2-10-3-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1
InChIKey: SLTGLTLBIVDQKE-BYPYZUCNSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Glehnia littoralis | Glehnia | Apiaceae | Apiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 148.162
TPSA？: 98.57
MolLogP？: -1.6263999999999983
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus subtilis | Bacillus subtilis | Activity | 6.0 | % | 10.1038/nchembio842 |
| Bacillus subtilis | Bacillus subtilis | Activity | 65.0 | % | 10.1038/nchembio842 |
| Bacillus subtilis | Bacillus subtilis | Activity | 71.0 | % | 10.1038/nchembio842 |
| Bacillus subtilis | Bacillus subtilis | Activity | nan | None | 10.1038/nchembio842 |
| Bacillus subtilis | Bacillus subtilis | MIC | 26000.0 | nM | 10.1021/jm500868e |
| Bacillus subtilis | Bacillus subtilis | MIC | 173000.0 | nM | 10.1038/nchembio842 |
| Bacillus subtilis | Bacillus subtilis | MIC | 1560000.0 | nM | 10.1038/nchembio842 |
| Homo sapiens | Cytochrome P450 1A2 | AC50 | 7943.28 | nM | None |
| Homo sapiens | Cytochrome P450 2C19 | AC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2C9 | AC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2D6 | AC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 3A4 | AC50 | nan | None | None |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | IC50 | 19952.62 | nM | 10.6019/CHEMBL4651402 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | IC50 | 20000.0 | nM | 10.6019/CHEMBL4651402 |
| None | Nucleic Acid | INH | 2.3 | Miller_unit | 10.1038/nchembio842 |
| None | Nucleic Acid | INH | 100.0 | Miller_unit | 10.1038/nchembio842 |
| None | Nucleic Acid | INH | 118.0 | Miller_unit | 10.1038/nchembio842 |
| None | Nucleic Acid | Kd | 13000.0 | nM | 10.1038/nchembio842 |
| None | Nucleic Acid | Kd | 26000.0 | nM | 10.1038/nchembio842 |
| None | Nucleic Acid | Kd | 29000.0 | nM | 10.1038/nchembio842 |
| None | Nucleic Acid | Kd | 75000.0 | nM | 10.1038/nchembio842 |
| None | Unchecked | Kd | 13000.0 | nM | 10.1021/jm500868e |