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DocumentationIdentifier: MM300277
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM300277 |
| SMILES |
CC(=CCF)C(O)C(C)C
|
| InChIKey |
SDXLGJGPLAEGEL-UHFFFAOYSA-N
|
| MW [Da] |
146.21
Automatically obtained from RDkit software. |
| LogP |
1.92
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM175068
Similarity: 0.7742
Similarity to MM175068
| Tanimoto metric | 0.7742 |
|---|---|
| Cosine metric | 0.8799 |
| Dice metric | 0.8727 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM295843
Similarity: 0.6531
Similarity to MM295843
| Tanimoto metric | 0.6531 |
|---|---|
| Cosine metric | 0.7903 |
| Dice metric | 0.7901 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM300275
Similarity: 0.64
Similarity to MM300275
| Tanimoto metric | 0.64 |
|---|---|
| Cosine metric | 0.7805 |
| Dice metric | 0.7805 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+575 more
