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DocumentationIdentifier: MM275234
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM275234 |
| SMILES |
C=C(C)C(C=O)CC(C)C
|
| InChIKey |
XQDMALAQCBBXTE-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
2.42
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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MM393244
Similarity: 0.7611
Similarity to MM393244
| Tanimoto metric | 0.7611 |
|---|---|
| Cosine metric | 0.8643 |
| Dice metric | 0.8643 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM378022
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| Tanimoto metric | 0.7434 |
|---|---|
| Cosine metric | 0.8528 |
| Dice metric | 0.8528 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM351118
Similarity: 0.6838
Similarity to MM351118
| Tanimoto metric | 0.6838 |
|---|---|
| Cosine metric | 0.8122 |
| Dice metric | 0.8122 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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