Chemical Name - Levodopa
Mol Weight - 197.189
Smiles - N[C@@H](Cc(cc1)cc(O)c1O)C(O)=O
Mol Weight - 197.189
Smiles - N[C@@H](Cc(cc1)cc(O)c1O)C(O)=O
| Property Value | |
| Mol Name | Levodopa |
| Molweight | 197.189 |
| Monoisotopic Mass | 197.068809 |
| Clogp | -2.2406 |
| Clogs | -0.949 |
| H Acceptors | 5 |
| H Donors | 4 |
| Total Surface Area | 144.84 |
| Relative Psa | 0.46679 |
| Polar Surface Area | 103.78 |
| Druglikeness | -11.045 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.64286 |
| Molecular Flexibility | 0.55481 |
| Molecular Complexity | 0.58251 |
| Fragments | 1 |
| Non H Atoms | 14 |
| Non Ch Atoms | 5 |
| Electronegative Atoms | 5 |
| Stereo Centers | 1 |
| Rotatable Bonds | 3 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 6 |
| Amines | 1 |
| Alkyl Amines | 1 |
| Basic Nitrogens | 1 |
| Acidic Oxygens | 1 |
| Smiles | N[C@@H](Cc(cc1)cc(O)c1O)C(O)=O |
| InChIKey | InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)/t6-/m0/s1 |
| InChI | WTDRDQBEARUVNC-LURJTMIESA-N |
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