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DocumentationIdentifier: MM210322
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM210322 |
| SMILES |
CC1(CNC2CC2)CC1
|
| InChIKey |
LSGQOAQAVKIUAD-UHFFFAOYSA-N
|
| MW [Da] |
125.22
Automatically obtained from RDkit software. |
| LogP |
1.54
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149489
Similarity: 0.8652
Similarity to MM149489
| Tanimoto metric | 0.8652 |
|---|---|
| Cosine metric | 0.9301 |
| Dice metric | 0.9277 |
| MW: | 127.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM325006
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Similarity to MM325006
| Tanimoto metric | 0.8351 |
|---|---|
| Cosine metric | 0.9101 |
| Dice metric | 0.9101 |
| MW: | 141.26 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM230914
Similarity: 0.8211
Similarity to MM230914
| Tanimoto metric | 0.8211 |
|---|---|
| Cosine metric | 0.9021 |
| Dice metric | 0.9017 |
| MW: | 141.26 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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