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DocumentationIdentifier: MM346284
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM346284 |
| SMILES |
C#CC1(C)CN1CCC=O
|
| InChIKey |
OUOXANXZPSQENP-UHFFFAOYSA-N
|
| MW [Da] |
137.18
Automatically obtained from RDkit software. |
| LogP |
0.28
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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MM177320
Similarity: 0.8631
Similarity to MM177320
| Tanimoto metric | 0.8631 |
|---|---|
| Cosine metric | 0.929 |
| Dice metric | 0.9265 |
| MW: | 123.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM373558
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| Tanimoto metric | 0.8382 |
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| Cosine metric | 0.9134 |
| Dice metric | 0.9119 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.72 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM271665
Similarity: 0.8352
Similarity to MM271665
| Tanimoto metric | 0.8352 |
|---|---|
| Cosine metric | 0.911 |
| Dice metric | 0.9102 |
| MW: | 137.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+189 more
