Chemical Name - L-Aspartic Acid
Mol Weight - 133.103
Smiles - N[C@@H](CC(O)=O)C(O)=O
Mol Weight - 133.103
Smiles - N[C@@H](CC(O)=O)C(O)=O
| Property Value | |
| Mol Name | L-Aspartic Acid |
| Molweight | 133.103 |
| Monoisotopic Mass | 133.037509 |
| Clogp | -3.813 |
| Clogs | -0.151 |
| H Acceptors | 5 |
| H Donors | 3 |
| Total Surface Area | 96.48 |
| Relative Psa | 0.70015 |
| Polar Surface Area | 100.62 |
| Druglikeness | -11.987 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.66667 |
| Molecular Flexibility | 0.78712 |
| Molecular Complexity | 0.62123 |
| Fragments | 1 |
| Non H Atoms | 9 |
| Non Ch Atoms | 5 |
| Electronegative Atoms | 5 |
| Stereo Centers | 1 |
| Rotatable Bonds | 3 |
| Sp3 Atoms | 5 |
| Amines | 1 |
| Alkyl Amines | 1 |
| Basic Nitrogens | 1 |
| Acidic Oxygens | 2 |
| Smiles | N[C@@H](CC(O)=O)C(O)=O |
| InChIKey | InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1 |
| InChI | CKLJMWTZIZZHCS-REOHCLBHSA-N |
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1 - L-Aspartic Acid
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