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DocumentationIdentifier: MM406707
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM406707 |
| SMILES |
C#CC=CCN(C=N)CC
|
| InChIKey |
ZCBXEECNLYUNMG-UHFFFAOYSA-N
|
| MW [Da] |
136.2
Automatically obtained from RDkit software. |
| LogP |
1.1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM388351
Similarity: 0.6961
Similarity to MM388351
| Tanimoto metric | 0.6961 |
|---|---|
| Cosine metric | 0.8215 |
| Dice metric | 0.8208 |
| MW: | 136.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM406633
Similarity: 0.6804
Similarity to MM406633
| Tanimoto metric | 0.6804 |
|---|---|
| Cosine metric | 0.81 |
| Dice metric | 0.8098 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM406635
Similarity: 0.6535
Similarity to MM406635
| Tanimoto metric | 0.6535 |
|---|---|
| Cosine metric | 0.7904 |
| Dice metric | 0.7904 |
| MW: | 137.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+160 more
