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DocumentationIdentifier: MM389244
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM389244 |
| SMILES |
CNC(=N)C(C#N)N(C)C
|
| InChIKey |
LKLTYHQCYBEMPT-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
-0.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM45266
Similarity: 0.7971
Similarity to MM45266
| Tanimoto metric | 0.7971 |
|---|---|
| Cosine metric | 0.8928 |
| Dice metric | 0.8871 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM181050
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| Tanimoto metric | 0.7754 |
|---|---|
| Cosine metric | 0.8805 |
| Dice metric | 0.8735 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM45537
Similarity: 0.6727
Similarity to MM45537
| Tanimoto metric | 0.6727 |
|---|---|
| Cosine metric | 0.8043 |
| Dice metric | 0.8043 |
| MW: | 139.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+89 more
