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DocumentationIdentifier: MM240289
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM240289 |
| SMILES |
CCC(C)(C)CC=COC
|
| InChIKey |
YUIPJZYGWGYNCW-UHFFFAOYSA-N
|
| MW [Da] |
142.24
Automatically obtained from RDkit software. |
| LogP |
2.97
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM372317
Similarity: 0.7368
Similarity to MM372317
| Tanimoto metric | 0.7368 |
|---|---|
| Cosine metric | 0.8485 |
| Dice metric | 0.8485 |
| MW: | 142.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM406150
Similarity: 0.6548
Similarity to MM406150
| Tanimoto metric | 0.6548 |
|---|---|
| Cosine metric | 0.7924 |
| Dice metric | 0.7914 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279862
Similarity: 0.6471
Similarity to MM279862
| Tanimoto metric | 0.6471 |
|---|---|
| Cosine metric | 0.787 |
| Dice metric | 0.7857 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+582 more
