4-Ureido-butyric acid
PubChem CID: 1571307
Connections displayed (default: 10).
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| Compound Synonyms | 4-Ureido-butyric acid, 2609-10-1, 4-ureidobutanoic acid, 4-(carbamoylamino)butanoic acid, UPCMLD00WJAB3, MLS001048990, CHEMBL310895, SCHEMBL2035521, DTXSID40364456, CHEBI:232970, HMS2268O11, STL570139, AKOS000116496, SMR000387004, EN300-05620, VU0607333-1, 4-[(Aminocarbonyl)amino]butanoic acid, AldrichCPR, Z56912008, F3250-0724 |
|---|---|
| Topological Polar Surface Area | 92.4 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 135.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | Q9ES14, Q96QE3 |
| Iupac Name | 4-(carbamoylamino)butanoic acid |
| Prediction Hob | 1.0 |
| Xlogp | -1.2 |
| Molecular Formula | C5H10N2O3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | QYTWIMMLQKHPGL-UHFFFAOYSA-N |
| Fcsp3 | 0.6 |
| Logs | -0.938 |
| Rotatable Bond Count | 4.0 |
| Logd | -1.22 |
| Compound Name | 4-Ureido-butyric acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 146.069 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 146.069 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 146.14 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -0.1389052 |
| Inchi | InChI=1S/C5H10N2O3/c6-5(10)7-3-1-2-4(8)9/h1-3H2,(H,8,9)(H3,6,7,10) |
| Smiles | C(CC(=O)O)CNC(=O)N |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Glycyrrhiza Glabra (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Litchi Chinensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Lobularia Maritima (Plant) Rel Props:Source_db:npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Piper Nigrum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 5. Outgoing r'ship
FOUND_INto/from Prosopis Juliflora (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all