Mol Weight - 175.187
Smiles - N[C@@H](CCCNC(N)=O)C(O)=O
| Property Name | Property Value |
| Mol Name | [L-(+)-2-amino-5-ureidovaleric Acid] |
| Molweight | 175.187 |
| Monoisotopic Mass | 175.095692 |
| Clogp | -3.6211 |
| Clogs | -0.976 |
| H Acceptors | 6 |
| H Donors | 4 |
| Total Surface Area | 137.63 |
| Relative Psa | 0.58984 |
| Polar Surface Area | 118.44 |
| Druglikeness | -12.666 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.75 |
| Molecular Flexibility | 0.70784 |
| Molecular Complexity | 0.51299 |
| Fragments | 1 |
| Non H Atoms | 12 |
| Non Ch Atoms | 6 |
| Electronegative Atoms | 6 |
| Stereo Centers | 1 |
| Rotatable Bonds | 5 |
| Sp3 Atoms | 6 |
| Amides | 2 |
| Amines | 1 |
| Alkyl Amines | 1 |
| Basic Nitrogens | 1 |
| Acidic Oxygens | 1 |
| Smiles | N[C@@H](CCCNC(N)=O)C(O)=O |
| InChIKey | InChI=1S/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)/t4-/m0/s1 |
| InChI | RHGKLRLOHDJJDR-BYPYZUCNSA-N |
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1 — [L-(+)-2-amino-5-ureidovaleric Acid] | 2 — [L-(+)-2-amino-5-ureidovaleric Acid]