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DocumentationIdentifier: MM134366
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM134366 |
| SMILES |
NC(=O)C=C(F)C(N)=O
|
| InChIKey |
PAHQFOAFEYAKLP-UHFFFAOYSA-N
|
| MW [Da] |
132.09
Automatically obtained from RDkit software. |
| LogP |
-1.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM161895
Similarity: 0.7179
Similarity to MM161895
| Tanimoto metric | 0.7179 |
|---|---|
| Cosine metric | 0.8367 |
| Dice metric | 0.8358 |
| MW: | 135.07 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM270592
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| Tanimoto metric | 0.7164 |
|---|---|
| Cosine metric | 0.8464 |
| Dice metric | 0.8348 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM109232
Similarity: 0.646
Similarity to MM109232
| Tanimoto metric | 0.646 |
|---|---|
| Cosine metric | 0.7854 |
| Dice metric | 0.7849 |
| MW: | 121.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+112 more
