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DocumentationIdentifier: MM264845
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM264845 |
| SMILES |
C=C(C#CC)NC(=O)CC
|
| InChIKey |
QGJSJNDSLGMBQI-UHFFFAOYSA-N
|
| MW [Da] |
137.18
Automatically obtained from RDkit software. |
| LogP |
1.05
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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MM142798
Similarity: 0.8175
Similarity to MM142798
| Tanimoto metric | 0.8175 |
|---|---|
| Cosine metric | 0.9041 |
| Dice metric | 0.8996 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM135943
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| Tanimoto metric | 0.7619 |
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| Cosine metric | 0.8729 |
| Dice metric | 0.8649 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.66 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM263861
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Similarity to MM263861
| Tanimoto metric | 0.7103 |
|---|---|
| Cosine metric | 0.8308 |
| Dice metric | 0.8306 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+389 more
