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DocumentationIdentifier: MM245688
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM245688 |
| SMILES |
CCC(=N)NC(C)C(=N)N
|
| InChIKey |
BWRFQZDMHAFMFE-UHFFFAOYSA-N
|
| MW [Da] |
142.21
Automatically obtained from RDkit software. |
| LogP |
0.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133740
Similarity: 0.7953
Similarity to MM133740
| Tanimoto metric | 0.7953 |
|---|---|
| Cosine metric | 0.8918 |
| Dice metric | 0.886 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM144935
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| Tanimoto metric | 0.6614 |
|---|---|
| Cosine metric | 0.8133 |
| Dice metric | 0.7962 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.1 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM247120
Similarity: 0.6456
Similarity to MM247120
| Tanimoto metric | 0.6456 |
|---|---|
| Cosine metric | 0.7848 |
| Dice metric | 0.7846 |
| MW: | 142.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+40 more
