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DocumentationIdentifier: MM392517
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM392517 |
| SMILES |
CCCCC(C=O)C(C)C
|
| InChIKey |
OGDMZPMAVHIUPM-UHFFFAOYSA-N
|
| MW [Da] |
142.24
Automatically obtained from RDkit software. |
| LogP |
2.65
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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MM376434
Similarity: 0.8923
Similarity to MM376434
| Tanimoto metric | 0.8923 |
|---|---|
| Cosine metric | 0.9439 |
| Dice metric | 0.9431 |
| MW: | 142.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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| Cosine metric | 0.9186 |
| Dice metric | 0.9153 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.26 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM179686
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Similarity to MM179686
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|---|---|
| Cosine metric | 0.9186 |
| Dice metric | 0.9153 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+383 more
