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DocumentationIdentifier: MM349923
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM349923 |
| SMILES |
C#CC(C)N(C)C(=N)CN
|
| InChIKey |
OWGNBIBIKIUFRX-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
-0.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM172663
Similarity: 0.6866
Similarity to MM172663
| Tanimoto metric | 0.6866 |
|---|---|
| Cosine metric | 0.8286 |
| Dice metric | 0.8142 |
| MW: | 125.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM142469
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Similarity to MM142469
| Tanimoto metric | 0.6567 |
|---|---|
| Cosine metric | 0.8104 |
| Dice metric | 0.7928 |
| MW: | 125.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM160411
Similarity: 0.6567
Similarity to MM160411
| Tanimoto metric | 0.6567 |
|---|---|
| Cosine metric | 0.8104 |
| Dice metric | 0.7928 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+127 more
