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DocumentationIdentifier: MM280742
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM280742 |
| SMILES |
O=CC=CNC(=O)C=CF
|
| InChIKey |
PCEFXDJTKXIMQM-UHFFFAOYSA-N
|
| MW [Da] |
143.12
Automatically obtained from RDkit software. |
| LogP |
0.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM157429
Similarity: 0.8842
Similarity to MM157429
| Tanimoto metric | 0.8842 |
|---|---|
| Cosine metric | 0.9403 |
| Dice metric | 0.9385 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM280741
Similarity: 0.7925
Similarity to MM280741
| Tanimoto metric | 0.7925 |
|---|---|
| Cosine metric | 0.8842 |
| Dice metric | 0.8842 |
| MW: | 141.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM49262
Similarity: 0.7789
Similarity to MM49262
| Tanimoto metric | 0.7789 |
|---|---|
| Cosine metric | 0.8826 |
| Dice metric | 0.8757 |
| MW: | 125.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | |||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+293 more
