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DocumentationIdentifier: MM134018
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM134018 |
| SMILES |
C=C(C)CC(=O)C(=C)C
|
| InChIKey |
OVTCGEGPTDACTQ-UHFFFAOYSA-N
|
| MW [Da] |
124.18
Automatically obtained from RDkit software. |
| LogP |
2.1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM269663
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| Tanimoto metric | 0.7961 |
|---|---|
| Cosine metric | 0.8923 |
| Dice metric | 0.8865 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM246793
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| Tanimoto metric | 0.7885 |
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||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
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| LogP: | 2.49 |
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MM246954
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Similarity to MM246954
| Tanimoto metric | 0.7455 |
|---|---|
| Cosine metric | 0.8634 |
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
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Total active interactions
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+463 more
