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DocumentationIdentifier: MM154871
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM154871 |
| SMILES |
C=CCOCC=C(C)F
|
| InChIKey |
SJKGNJVXGDCGDD-UHFFFAOYSA-N
|
| MW [Da] |
130.16
Automatically obtained from RDkit software. |
| LogP |
2.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM106535
Similarity: 0.9138
Similarity to MM106535
| Tanimoto metric | 0.9138 |
|---|---|
| Cosine metric | 0.9559 |
| Dice metric | 0.955 |
| MW: | 118.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM154834
Similarity: 0.7681
Similarity to MM154834
| Tanimoto metric | 0.7681 |
|---|---|
| Cosine metric | 0.8699 |
| Dice metric | 0.8689 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM370186
Similarity: 0.7632
Similarity to MM370186
| Tanimoto metric | 0.7632 |
|---|---|
| Cosine metric | 0.8736 |
| Dice metric | 0.8657 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+473 more
