Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationAlpha-Methoxy-p-Toluic Acid
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM00626 |
| SMILES |
COCc1ccc(C(=O)O)cc1
|
| InChIKey |
OORFINRYBCDBEN-UHFFFAOYSA-N
|
| MW [Da] |
166.18
Automatically obtained from RDkit software. |
| LogP |
1.53
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
308473
|
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
Alpha-Hydroxy-p-Toluic Acid
Similarity: 0.8658
Similarity to Alpha-Hydroxy-p-Toluic Acid
| Tanimoto metric | 0.8658 |
|---|---|
| Cosine metric | 0.9305 |
| Dice metric | 0.9281 |
| MW: | 152.15 |
||||
|---|---|---|---|---|---|
| PI: | 4
Total passive interactions
|
| LogP: | 0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
4-Methylbenzoic Acid
Similarity: 0.8389
Similarity to 4-Methylbenzoic Acid
| Tanimoto metric | 0.8389 |
|---|---|
| Cosine metric | 0.9159 |
| Dice metric | 0.9124 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 6
Total passive interactions
|
| LogP: | 1.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
Benzoic Acid
Similarity: 0.698
Similarity to Benzoic Acid
| Tanimoto metric | 0.698 |
|---|---|
| Cosine metric | 0.8355 |
| Dice metric | 0.8221 |
| MW: | 122.12 |
||||
|---|---|---|---|---|---|
| PI: | 16
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+39 more
