Chemical Name - Malic Acid
Mol Weight - 134.087
Smiles - OC(CC(O)=O)C(O)=O
Mol Weight - 134.087
Smiles - OC(CC(O)=O)C(O)=O
| Property Value | |
| Mol Name | Malic Acid |
| Molweight | 134.087 |
| Monoisotopic Mass | 134.021525 |
| Clogp | -1.6884 |
| Clogs | -0.075 |
| H Acceptors | 5 |
| H Donors | 3 |
| Total Surface Area | 94.31 |
| Relative Psa | 0.69325 |
| Polar Surface Area | 94.83 |
| Druglikeness | 0.70851 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Shape Index | 0.66667 |
| Molecular Flexibility | 0.80705 |
| 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 |
| Acidic Oxygens | 2 |
| Smiles | OC(CC(O)=O)C(O)=O |
| InChIKey | |
| InChI | C4H6O5 |
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1 - Malic Acid
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2 - Malic Acid
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