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DocumentationIdentifier: MM253905
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM253905 |
| SMILES |
N=C(N)C(N)C(F)C(N)=O
|
| InChIKey |
RCDOEQISMXKQBW-UHFFFAOYSA-N
|
| MW [Da] |
148.14
Automatically obtained from RDkit software. |
| LogP |
-1.93
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133710
Similarity: 0.5744
Similarity to MM133710
| Tanimoto metric | 0.5744 |
|---|---|
| Cosine metric | 0.7579 |
| Dice metric | 0.7296 |
| MW: | 130.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM222268
Similarity: 0.4812
Similarity to MM222268
| Tanimoto metric | 0.4812 |
|---|---|
| Cosine metric | 0.6531 |
| Dice metric | 0.6497 |
| MW: | 151.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253920
Similarity: 0.422
Similarity to MM253920
| Tanimoto metric | 0.422 |
|---|---|
| Cosine metric | 0.5937 |
| Dice metric | 0.5935 |
| MW: | 149.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
