Chemical Name - VERATRIC ACID
Mol Weight - 182.174
Smiles - COc(ccc(C(O)=O)c1)c1OC
Mol Weight - 182.174
Smiles - COc(ccc(C(O)=O)c1)c1OC
| Property Value | |
| Mol Name | VERATRIC ACID |
| Molweight | 182.174 |
| Monoisotopic Mass | 182.05791 |
| Clogp | 1.0047 |
| Clogs | -1.665 |
| H Acceptors | 4 |
| H Donors | 1 |
| Total Surface Area | 141.88 |
| Relative Psa | 0.3252 |
| Polar Surface Area | 55.76 |
| Druglikeness | -1.597 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.61538 |
| Molecular Flexibility | 0.46221 |
| Molecular Complexity | 0.68786 |
| Fragments | 1 |
| Non H Atoms | 13 |
| Non Ch Atoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bonds | 3 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 5 |
| Acidic Oxygens | 1 |
| Smiles | COc(ccc(C(O)=O)c1)c1OC |
| InChIKey | |
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