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DocumentationIdentifier: MM432146
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM432146 |
| SMILES |
C=CCC(CN1CC1)NC
|
| InChIKey |
MLUVZLPOXCMYCT-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
0.47
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM208392
Similarity: 0.7829
Similarity to MM208392
| Tanimoto metric | 0.7829 |
|---|---|
| Cosine metric | 0.8848 |
| Dice metric | 0.8783 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM309126
Similarity: 0.6273
Similarity to MM309126
| Tanimoto metric | 0.6273 |
|---|---|
| Cosine metric | 0.7711 |
| Dice metric | 0.771 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM438610
Similarity: 0.6265
Similarity to MM438610
| Tanimoto metric | 0.6265 |
|---|---|
| Cosine metric | 0.7711 |
| Dice metric | 0.7704 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+65 more
