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DocumentationIdentifier: MM179838
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM179838 |
| SMILES |
CCN(CCN)C(C)=N
|
| InChIKey |
HBABNAUJBMCPNW-UHFFFAOYSA-N
|
| MW [Da] |
129.21
Automatically obtained from RDkit software. |
| LogP |
0.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM108217
Similarity: 0.8696
Similarity to MM108217
| Tanimoto metric | 0.8696 |
|---|---|
| Cosine metric | 0.9325 |
| Dice metric | 0.9302 |
| MW: | 115.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172426
Similarity: 0.6897
Similarity to MM172426
| Tanimoto metric | 0.6897 |
|---|---|
| Cosine metric | 0.8179 |
| Dice metric | 0.8163 |
| MW: | 130.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM301853
Similarity: 0.6742
Similarity to MM301853
| Tanimoto metric | 0.6742 |
|---|---|
| Cosine metric | 0.8076 |
| Dice metric | 0.8054 |
| MW: | 142.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+400 more
