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DocumentationIdentifier: MM284034
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM284034 |
| SMILES |
C=CC=C(C)OC=CC=O
|
| InChIKey |
FSIQPUFWLSPGCR-UHFFFAOYSA-N
|
| MW [Da] |
138.17
Automatically obtained from RDkit software. |
| LogP |
1.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM169000
Similarity: 0.7882
Similarity to MM169000
| Tanimoto metric | 0.7882 |
|---|---|
| Cosine metric | 0.8878 |
| Dice metric | 0.8816 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM284033
Similarity: 0.7614
Similarity to MM284033
| Tanimoto metric | 0.7614 |
|---|---|
| Cosine metric | 0.8686 |
| Dice metric | 0.8645 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM159123
Similarity: 0.6957
Similarity to MM159123
| Tanimoto metric | 0.6957 |
|---|---|
| Cosine metric | 0.8238 |
| Dice metric | 0.8205 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+165 more
