N,N-Dimethyl-L-serine
PubChem CID: 54353682
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| Compound Synonyms | L-Serine, N,N-dimethyl-, 2812-34-2, n,n-dimethylserine, (2S)-2-(dimethylamino)-3-hydroxypropanoic acid, N,N-dimethyl-L-serine, RPZ2LNJ9BS, Serine, N,N-dimethyl-, L-, NSC-45509, NSC45509, UNII-RPZ2LNJ9BS, (S)-2-(Dimethylamino)-3-hydroxypropanoic acid, SCHEMBL199041, DTXSID101314986, MFCD19228808, AKOS006377074, DB-214054, EN300-392798, F96954, 843-330-8 |
|---|---|
| Topological Polar Surface Area | 60.8 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 9.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 102.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (2S)-2-(dimethylamino)-3-hydroxypropanoic acid |
| Prediction Hob | 1.0 |
| Xlogp | -3.1 |
| Molecular Formula | C5H11NO3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | UHOZUUWRLMQQBZ-BYPYZUCNSA-N |
| Fcsp3 | 0.8 |
| Logs | 0.335 |
| Rotatable Bond Count | 3.0 |
| Logd | -1.121 |
| Compound Name | N,N-Dimethyl-L-serine |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 133.074 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 133.074 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 133.15 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 1.4665886000000001 |
| Inchi | InChI=1S/C5H11NO3/c1-6(2)4(3-7)5(8)9/h4,7H,3H2,1-2H3,(H,8,9)/t4-/m0/s1 |
| Smiles | CN(C)[C@@H](CO)C(=O)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Hymenocallis Littoralis (Plant) Rel Props:Source_db:cmaup_ingredients