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DocumentationIdentifier: MM438610
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM438610 |
| SMILES |
CCC(CN1CC1C)NC
|
| InChIKey |
HRGUCELOWGCONO-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM184554
Similarity: 0.8014
Similarity to MM184554
| Tanimoto metric | 0.8014 |
|---|---|
| Cosine metric | 0.8952 |
| Dice metric | 0.8898 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM184564
Similarity: 0.773
Similarity to MM184564
| Tanimoto metric | 0.773 |
|---|---|
| Cosine metric | 0.8792 |
| Dice metric | 0.872 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402389
Similarity: 0.7325
Similarity to MM402389
| Tanimoto metric | 0.7325 |
|---|---|
| Cosine metric | 0.8462 |
| Dice metric | 0.8456 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+212 more
