Chemical Name - Sulphanilic Acid
Mol Weight - 173.192
Smiles - Nc(cc1)ccc1S(O)(=O)=O
Mol Weight - 173.192
Smiles - Nc(cc1)ccc1S(O)(=O)=O
| Property Value | |
| Mol Name | Sulphanilic Acid |
| Molweight | 173.192 |
| Monoisotopic Mass | 173.014664 |
| Clogp | -1.247 |
| Clogs | -0.298 |
| H Acceptors | 4 |
| H Donors | 2 |
| Total Surface Area | 116.71 |
| Relative Psa | 0.48796 |
| Polar Surface Area | 88.77 |
| Druglikeness | -0.69382 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Shape Index | 0.63636 |
| Molecular Flexibility | 0.47198 |
| Molecular Complexity | 0.64378 |
| Fragments | 1 |
| Non H Atoms | 11 |
| Non Ch Atoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bonds | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 2 |
| Symmetric Atoms | 3 |
| Amines | 1 |
| Aromatic Amines | 1 |
| Acidic Oxygens | 1 |
| Smiles | Nc(cc1)ccc1S(O)(=O)=O |
| InChIKey | InChI=1S/C6H7NO3S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H,8,9,10) |
| InChI | HVBSAKJJOYLTQU-UHFFFAOYSA-N |
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1 - Sulphanilic Acid
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