Log in
Browse 
Membranes
Search
Statistics
Lab
Documentation3-Hydroxyphenylacetic Acid
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM00604 |
| SMILES |
O=C(O)Cc1cccc(O)c1
|
| InChIKey |
FVMDYYGIDFPZAX-UHFFFAOYSA-N
|
| MW [Da] |
152.15
Automatically obtained from RDkit software. |
| LogP |
1.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
12122
|
|
DrugBank |
N/A |
|
ChEBI |
17445
|
|
PDB |
N/A |
|
ChEMBL |
CHEMBL190035
|
Similar entries
3,4-Dihydroxyphenylacetic Acid
Similarity: 0.8155
Similarity to 3,4-Dihydroxyphenylacetic Acid
| Tanimoto metric | 0.8155 |
|---|---|
| Cosine metric | 0.903 |
| Dice metric | 0.8983 |
| MW: | 168.15 |
||||
|---|---|---|---|---|---|
| PI: | 8
Total passive interactions
|
| LogP: | 0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
4-hydroxyphenylacetic Acid
Similarity: 0.7184
Similarity to 4-hydroxyphenylacetic Acid
| Tanimoto metric | 0.7184 |
|---|---|
| Cosine metric | 0.8384 |
| Dice metric | 0.8362 |
| MW: | 152.15 |
||||
|---|---|---|---|---|---|
| PI: | 8
Total passive interactions
|
| LogP: | 1.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
Methyl 4-hydroxyphenylacetate
Similarity: 0.6352
Similarity to Methyl 4-hydroxyphenylacetate
| Tanimoto metric | 0.6352 |
|---|---|
| Cosine metric | 0.7769 |
| Dice metric | 0.7769 |
| MW: | 166.18 |
||||
|---|---|---|---|---|---|
| PI: | 4
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+21 more
