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DocumentationIdentifier: MM233805
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM233805 |
| SMILES |
CC(N)(CCN)CNC=N
|
| InChIKey |
WDVUAKMPKFNPNY-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
-0.75
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM138224
Similarity: 0.783
Similarity to MM138224
| Tanimoto metric | 0.783 |
|---|---|
| Cosine metric | 0.8849 |
| Dice metric | 0.8783 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM239399
Similarity: 0.675
Similarity to MM239399
| Tanimoto metric | 0.675 |
|---|---|
| Cosine metric | 0.8072 |
| Dice metric | 0.806 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM155745
Similarity: 0.5849
Similarity to MM155745
| Tanimoto metric | 0.5849 |
|---|---|
| Cosine metric | 0.7648 |
| Dice metric | 0.7381 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+188 more
