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DocumentationIdentifier: MM108164
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM108164 |
| SMILES |
N=C(N)C(N)CCN
|
| InChIKey |
QENBWDDHJVCGFP-UHFFFAOYSA-N
|
| MW [Da] |
116.17
Automatically obtained from RDkit software. |
| LogP |
-1.4
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133628
Similarity: 0.7083
Similarity to MM133628
| Tanimoto metric | 0.7083 |
|---|---|
| Cosine metric | 0.8416 |
| Dice metric | 0.8293 |
| MW: | 130.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM104267
Similarity: 0.6923
Similarity to MM104267
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8186 |
| Dice metric | 0.8182 |
| MW: | 116.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172373
Similarity: 0.6869
Similarity to MM172373
| Tanimoto metric | 0.6869 |
|---|---|
| Cosine metric | 0.8288 |
| Dice metric | 0.8144 |
| MW: | 130.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+326 more
