5-Amino-2-azaniumyl-5-oxopentanoate
PubChem CID: 25244553
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| Compound Synonyms | SCHEMBL23141037, BDBM93009 |
|---|---|
| Topological Polar Surface Area | 111.0 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 140.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 5-amino-2-azaniumyl-5-oxopentanoate |
| Nih Violation | False |
| Prediction Hob | 1.0 |
| Xlogp | -2.5 |
| Is Pains | False |
| Molecular Formula | C5H10N2O3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | ZDXPYRJPNDTMRX-UHFFFAOYSA-N |
| Fcsp3 | 0.6 |
| Rotatable Bond Count | 3.0 |
| Compound Name | 5-Amino-2-azaniumyl-5-oxopentanoate |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 146.069 |
| Formal Charge | 0.0 |
| Brenk Violation | False |
| Monoisotopic Mass | 146.069 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 146.14 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 1.5842948000000001 |
| Inchi | InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10) |
| Smiles | C(CC(=O)N)C(C(=O)[O-])[NH3+] |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Arabidopsis Thaliana (Plant) Rel Props:Source_db:cmaup_ingredients