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DocumentationIdentifier: MM348021
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM348021 |
| SMILES |
CC1(OC2(CN)CC2)CC1
|
| InChIKey |
YBRNBFDRVLHZET-UHFFFAOYSA-N
|
| MW [Da] |
141.21
Automatically obtained from RDkit software. |
| LogP |
1.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM210412
Similarity: 0.9841
Similarity to MM210412
| Tanimoto metric | 0.9841 |
|---|---|
| Cosine metric | 0.992 |
| Dice metric | 0.992 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM340728
Similarity: 0.9683
Similarity to MM340728
| Tanimoto metric | 0.9683 |
|---|---|
| Cosine metric | 0.984 |
| Dice metric | 0.9839 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM340730
Similarity: 0.9077
Similarity to MM340730
| Tanimoto metric | 0.9077 |
|---|---|
| Cosine metric | 0.9517 |
| Dice metric | 0.9516 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+118 more
