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DocumentationIdentifier: MM154848
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM154848 |
| SMILES |
CNCCOC=C(F)F
|
| InChIKey |
OECBHHCCKYYOHW-UHFFFAOYSA-N
|
| MW [Da] |
137.13
Automatically obtained from RDkit software. |
| LogP |
0.96
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM73629
Similarity: 0.8095
Similarity to MM73629
| Tanimoto metric | 0.8095 |
|---|---|
| Cosine metric | 0.8997 |
| Dice metric | 0.8947 |
| MW: | 119.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM106542
Similarity: 0.8095
Similarity to MM106542
| Tanimoto metric | 0.8095 |
|---|---|
| Cosine metric | 0.8997 |
| Dice metric | 0.8947 |
| MW: | 123.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM152954
Similarity: 0.6986
Similarity to MM152954
| Tanimoto metric | 0.6986 |
|---|---|
| Cosine metric | 0.8227 |
| Dice metric | 0.8226 |
| MW: | 133.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+549 more
