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DocumentationIdentifier: MM265943
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM265943 |
| SMILES |
C=C(CC)CC(C)=CC=O
|
| InChIKey |
OJLYKYKNOWLIED-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM273675
Similarity: 0.8431
Similarity to MM273675
| Tanimoto metric | 0.8431 |
|---|---|
| Cosine metric | 0.9149 |
| Dice metric | 0.9149 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM143052
Similarity: 0.7234
Similarity to MM143052
| Tanimoto metric | 0.7234 |
|---|---|
| Cosine metric | 0.8505 |
| Dice metric | 0.8395 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM266296
Similarity: 0.72
Similarity to MM266296
| Tanimoto metric | 0.72 |
|---|---|
| Cosine metric | 0.8409 |
| Dice metric | 0.8372 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+187 more
