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DocumentationIdentifier: MM209425
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM209425 |
| SMILES |
C=C(C=CC1CC1)OC
|
| InChIKey |
ZYZJYXZWBOZCEW-UHFFFAOYSA-N
|
| MW [Da] |
124.18
Automatically obtained from RDkit software. |
| LogP |
2.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM456129
Similarity: 0.7934
Similarity to MM456129
| Tanimoto metric | 0.7934 |
|---|---|
| Cosine metric | 0.8907 |
| Dice metric | 0.8848 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM456131
Similarity: 0.7619
Similarity to MM456131
| Tanimoto metric | 0.7619 |
|---|---|
| Cosine metric | 0.8729 |
| Dice metric | 0.8649 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM208800
Similarity: 0.5588
Similarity to MM208800
| Tanimoto metric | 0.5588 |
|---|---|
| Cosine metric | 0.7202 |
| Dice metric | 0.717 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+155 more
