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DocumentationIdentifier: MM258304
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM258304 |
| SMILES |
C#CC(=C)OCCC(C)F
|
| InChIKey |
UETISIWCIKMFAS-UHFFFAOYSA-N
|
| MW [Da] |
142.17
Automatically obtained from RDkit software. |
| LogP |
1.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM167058
Similarity: 0.7426
Similarity to MM167058
| Tanimoto metric | 0.7426 |
|---|---|
| Cosine metric | 0.8617 |
| Dice metric | 0.8523 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM366006
Similarity: 0.7364
Similarity to MM366006
| Tanimoto metric | 0.7364 |
|---|---|
| Cosine metric | 0.8496 |
| Dice metric | 0.8482 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM366079
Similarity: 0.6466
Similarity to MM366079
| Tanimoto metric | 0.6466 |
|---|---|
| Cosine metric | 0.7866 |
| Dice metric | 0.7853 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+254 more
