Allantoin
Representations & DB's id
| ||
| ChEBI: | CHEBI:15676 | |
|---|---|---|
| ChEMBL: | CHEMBL593429 | |
| PubChem: | 204 | |
| IUPAC: | (2,5-dioxoimidazolidin-4-yl)urea | |
| Standard InChI: | InChI=1S/C4H6N4O3/c5-3(10)6-1-2(9)8-4(11)7-1/h1H,(H3,5,6,10)(H2,7,8,9,11) | |
| Standard InChI Key: | POJWUDADGALRAB-UHFFFAOYSA-N | |
| SMILES: | OC(=N)NC1N=C(N=C1O)O | |
Molecular propeties
| ||
| AlogP: | -2.18 | |
|---|---|---|
| Hydrogen bonds acceptors: | 3 | |
| Hydrogen bonds donors: | 4 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 1 | |
| Molecular Weight: | 158.04 | |
| Topological polar surface area: | 113 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0 | |
| Number of carbons: | 4 | |