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DocumentationIdentifier: MM367378
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM367378 |
| SMILES |
CC#CCOCC(=O)CF
|
| InChIKey |
OZKNXIHVJHVBQA-UHFFFAOYSA-N
|
| MW [Da] |
144.15
Automatically obtained from RDkit software. |
| LogP |
0.56
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM15852
Similarity: 0.8636
Similarity to MM15852
| Tanimoto metric | 0.8636 |
|---|---|
| Cosine metric | 0.9293 |
| Dice metric | 0.9268 |
| MW: | 130.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM287880
Similarity: 0.6947
Similarity to MM287880
| Tanimoto metric | 0.6947 |
|---|---|
| Cosine metric | 0.8235 |
| Dice metric | 0.8199 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM367376
Similarity: 0.6634
Similarity to MM367376
| Tanimoto metric | 0.6634 |
|---|---|
| Cosine metric | 0.7985 |
| Dice metric | 0.7976 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+134 more
