(2S)-2-amino-3-(2-methylenecyclopropyl)propanoic acid
PubChem CID: 45039541
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| Compound Synonyms | (S)-Hypoglycine A, 85%, 1263274-08-3, CHEBI:134622, (2S)-2-amino-3-(2-methylenecyclopropyl)propanoic acid, SCHEMBL25660908, 3-(Methylencyclopropyl)-L-alanin, AKOS015902302 |
|---|---|
| Prediction Swissadme | 0.0 |
| Topological Polar Surface Area | 63.3 |
| Hydrogen Bond Donor Count | 2.0 |
| Inchi Key | OOJZCXFXPZGUBJ-GDVGLLTNSA-N |
| Fcsp3 | 0.5714285714285714 |
| Rotatable Bond Count | 3.0 |
| Heavy Atom Count | 10.0 |
| Compound Name | (2S)-2-amino-3-(2-methylenecyclopropyl)propanoic acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 141.079 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 141.079 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 176.0 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 141.17 |
| Database Name | cmaup_ingredients;pubchem |
| Covalent Unit Count | 1.0 |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (2S)-2-amino-3-(2-methylidenecyclopropyl)propanoic acid |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Prediction Hob | 1.0 |
| Esol | 1.0262460000000002 |
| Inchi | InChI=1S/C7H11NO2/c1-4-2-5(4)3-6(8)7(9)10/h5-6H,1-3,8H2,(H,9,10)/t5?,6-/m0/s1 |
| Smiles | C=C1CC1C[C@@H](C(=O)O)N |
| Xlogp | -2.5 |
| Defined Bond Stereocenter Count | 0.0 |
| Molecular Formula | C7H11NO2 |
- 1. Outgoing r'ship
FOUND_INto/from Blighia Sapida (Plant) Rel Props:Source_db:cmaup_ingredients