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DocumentationIdentifier: MM447871
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM447871 |
| SMILES |
C=COCOCCC=CF
|
| InChIKey |
OELIOALMFDWFPA-UHFFFAOYSA-N
|
| MW [Da] |
146.16
Automatically obtained from RDkit software. |
| LogP |
1.99
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM213144
Similarity: 0.806
Similarity to MM213144
| Tanimoto metric | 0.806 |
|---|---|
| Cosine metric | 0.8978 |
| Dice metric | 0.8926 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM290237
Similarity: 0.6437
Similarity to MM290237
| Tanimoto metric | 0.6437 |
|---|---|
| Cosine metric | 0.7848 |
| Dice metric | 0.7832 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM39183
Similarity: 0.6418
Similarity to MM39183
| Tanimoto metric | 0.6418 |
|---|---|
| Cosine metric | 0.8011 |
| Dice metric | 0.7818 |
| MW: | 116.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+641 more
