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DocumentationIdentifier: MM291689
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291689 |
| SMILES |
C#CCC(F)CCOC=O
|
| InChIKey |
VHJDROZSPHZPKB-UHFFFAOYSA-N
|
| MW [Da] |
144.15
Automatically obtained from RDkit software. |
| LogP |
0.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156032
Similarity: 0.8111
Similarity to MM156032
| Tanimoto metric | 0.8111 |
|---|---|
| Cosine metric | 0.9006 |
| Dice metric | 0.8957 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291255
Similarity: 0.6538
Similarity to MM291255
| Tanimoto metric | 0.6538 |
|---|---|
| Cosine metric | 0.7916 |
| Dice metric | 0.7907 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291256
Similarity: 0.6415
Similarity to MM291256
| Tanimoto metric | 0.6415 |
|---|---|
| Cosine metric | 0.7821 |
| Dice metric | 0.7816 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+396 more
