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DocumentationIdentifier: MM161895
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM161895 |
| SMILES |
NC(=O)C(F)=C(F)C=O
|
| InChIKey |
SPDJXSMOMRYOTA-UHFFFAOYSA-N
|
| MW [Da] |
135.07
Automatically obtained from RDkit software. |
| LogP |
-0.18
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM109232
Similarity: 0.8571
Similarity to MM109232
| Tanimoto metric | 0.8571 |
|---|---|
| Cosine metric | 0.9258 |
| Dice metric | 0.9231 |
| MW: | 121.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM134366
Similarity: 0.7179
Similarity to MM134366
| Tanimoto metric | 0.7179 |
|---|---|
| Cosine metric | 0.8367 |
| Dice metric | 0.8358 |
| MW: | 132.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM47818
Similarity: 0.6383
Similarity to MM47818
| Tanimoto metric | 0.6383 |
|---|---|
| Cosine metric | 0.7825 |
| Dice metric | 0.7792 |
| MW: | 131.08 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+87 more
