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DocumentationIdentifier: MM358990
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM358990 |
| SMILES |
C=C(C#CCC)N(C)C=N
|
| InChIKey |
RMTSFFQNMYXNMV-UHFFFAOYSA-N
|
| MW [Da] |
136.2
Automatically obtained from RDkit software. |
| LogP |
1.45
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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MM174697
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Similarity to MM174697
| Tanimoto metric | 0.8348 |
|---|---|
| Cosine metric | 0.9137 |
| Dice metric | 0.91 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM91275
Similarity: 0.7559
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| Tanimoto metric | 0.7559 |
|---|---|
| Cosine metric | 0.8614 |
| Dice metric | 0.861 |
| MW: | 137.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | |||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM158558
Similarity: 0.7304
Similarity to MM158558
| Tanimoto metric | 0.7304 |
|---|---|
| Cosine metric | 0.8547 |
| Dice metric | 0.8442 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+141 more
