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DocumentationIdentifier: MM373433
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM373433 |
| SMILES |
C#CC1(C)CN1CCCN
|
| InChIKey |
UFSKOEKZNWCECY-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
0.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM177320
Similarity: 0.8951
Similarity to MM177320
| Tanimoto metric | 0.8951 |
|---|---|
| Cosine metric | 0.9461 |
| Dice metric | 0.9446 |
| MW: | 123.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM373558
Similarity: 0.8795
Similarity to MM373558
| Tanimoto metric | 0.8795 |
|---|---|
| Cosine metric | 0.9366 |
| Dice metric | 0.9359 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM271665
Similarity: 0.843
Similarity to MM271665
| Tanimoto metric | 0.843 |
|---|---|
| Cosine metric | 0.915 |
| Dice metric | 0.9148 |
| MW: | 137.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+202 more
