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DocumentationIdentifier: MM307498
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM307498 |
| SMILES |
CC=C(C)C(C)(CC)CC
|
| InChIKey |
XZJBBBRQEDEVRK-UHFFFAOYSA-N
|
| MW [Da] |
140.27
Automatically obtained from RDkit software. |
| LogP |
3.78
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM137985
Similarity: 0.8721
Similarity to MM137985
| Tanimoto metric | 0.8721 |
|---|---|
| Cosine metric | 0.9339 |
| Dice metric | 0.9317 |
| MW: | 126.24 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM242719
Similarity: 0.75
Similarity to MM242719
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8573 |
| Dice metric | 0.8571 |
| MW: | 140.27 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM242785
Similarity: 0.6944
Similarity to MM242785
| Tanimoto metric | 0.6944 |
|---|---|
| Cosine metric | 0.8212 |
| Dice metric | 0.8197 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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