Showing Metabocard for 3-(carbamoylamino)propanoate (BASm0000258)
| Common Name | 3-(carbamoylamino)propanoate |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C4H7N2O3 |
| Average Mass | 131.11200 |
| Monoisotopic Mass | 131.04622 |
| IUPAC Name | 3-(carbamoylamino)propanoic acid |
| Traditional Name | 3-ureidopropionic acid |
| CAS Registry Number | Not Available |
| SMILES | NC(=O)NCCC(=O)[O-] |
| InChI Identifier | InChI=1S/C4H8N2O3/c5-4(9)6-2-1-3(7)8/h1-2H2,(H,7,8)(H3,5,6,9)/p-1 |
| InChI Key | JSJWCHRYRHKBBW-UHFFFAOYSA-M |
| CHEBI ID | CHEBI:11892 |
| MiMeDB ID | MMDBc0054213 |
| State | Expected Solid |
| Water Solubility | 5.27e+01 g/l |
| logP | -0.98 |
| logS | -0.40 |
| pKa (Strongest Acidic) | 4.23 |
| pKa (Strongest Basic) | -2.05 |
| Hydrogen Acceptor Count | 3 |
| Hydrogen Donor Count | 3 |
| Polar Surface Area | 92.42 Ų |
| Rotatable Bond Count | 3 |
| Physiological Charge | -1 |
| Formal Charge | 0 |
| Refractivity | 28.82 m³·mol⁻¹ |
| Polarizability | 12.07 |