2,3-Diaminopropanoic acid; (ξ)-form
AlkaPlorer ID: AK295301
Synonym: None
IUPAC Name: 2,3-diaminopropanoic acid
Structure
SMILES: NCC(N)C(=O)O
InChI: InChI=1S/C3H8N2O2/c4-1-2(5)3(6)7/h2H,1,4-5H2,(H,6,7)
InChIKey: PECYZEOJVXMISF-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 104.10899999999998
TPSA？: 89.34
MolLogP？: -1.6429999999999998
Number of H-Donors: 3
Number of H-Acceptors: 3
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Betaine transporter | IC50 | 630957.34 | nM | 10.1016/j.ejmech.2019.111920 |
| Homo sapiens | GABA transporter 1 | IC50 | 1000000.0 | nM | 10.1016/j.ejmech.2019.111920 |
| Homo sapiens | GABA transporter 2 | IC50 | 39810.72 | nM | 10.1016/j.ejmech.2019.111920 |
| Homo sapiens | GABA transporter 3 | IC50 | 31622.78 | nM | 10.1016/j.ejmech.2019.111920 |
| None | No relevant target | Activity | 20.0 | % | 10.1016/j.bmc.2009.02.018 |
| None | No relevant target | Activity | 98.0 | % | 10.1016/j.bmc.2009.02.018 |