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DocumentationIdentifier: MM176831
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM176831 |
| SMILES |
CCCN1CC1(C)CN
|
| InChIKey |
TUOHHIIDHXZPFF-UHFFFAOYSA-N
|
| MW [Da] |
128.22
Automatically obtained from RDkit software. |
| LogP |
0.43
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM372394
Similarity: 0.95
Similarity to MM372394
| Tanimoto metric | 0.95 |
|---|---|
| Cosine metric | 0.9747 |
| Dice metric | 0.9744 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372392
Similarity: 0.8986
Similarity to MM372392
| Tanimoto metric | 0.8986 |
|---|---|
| Cosine metric | 0.948 |
| Dice metric | 0.9466 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372396
Similarity: 0.8526
Similarity to MM372396
| Tanimoto metric | 0.8526 |
|---|---|
| Cosine metric | 0.9233 |
| Dice metric | 0.9204 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+296 more
