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DocumentationIdentifier: MM335141
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM335141 |
| SMILES |
CCC(F)=CC(CC)CC
|
| InChIKey |
AXWGYKZKIQSZRJ-UHFFFAOYSA-N
|
| MW [Da] |
144.23
Automatically obtained from RDkit software. |
| LogP |
3.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM143266
Similarity: 0.8837
Similarity to MM143266
| Tanimoto metric | 0.8837 |
|---|---|
| Cosine metric | 0.9401 |
| Dice metric | 0.9383 |
| MW: | 130.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM150608
Similarity: 0.814
Similarity to MM150608
| Tanimoto metric | 0.814 |
|---|---|
| Cosine metric | 0.9022 |
| Dice metric | 0.8974 |
| MW: | 130.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM266346
Similarity: 0.78
Similarity to MM266346
| Tanimoto metric | 0.78 |
|---|---|
| Cosine metric | 0.8769 |
| Dice metric | 0.8764 |
| MW: | 144.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+886 more
