Agmatine
Representations & DB's id
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| ChEBI: | CHEBI:17431 | |
|---|---|---|
| ChEMBL: | CHEMBL58343 | |
| PubChem: | 199 | |
| IUPAC: | 2-(4-aminobutyl)guanidine | |
| Standard InChI: | InChI=1S/C5H14N4/c6-3-1-2-4-9-5(7)8/h1-4,6H2,(H4,7,8,9) | |
| Standard InChI Key: | QYPPJABKJHAVHS-UHFFFAOYSA-N | |
| SMILES: | NCCCCNC(=N)N | |
Molecular propeties
| ||
| AlogP: | -1 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 3 | |
| Rotatable bonds: | 4 | |
| Number of rings: | 0 | |
| Molecular Weight: | 130.12 | |
| Topological polar surface area: | 90.4 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.8 | |
| Number of carbons: | 5 | |