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DocumentationIdentifier: MM267658
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM267658 |
| SMILES |
C=CC(=O)NCC(=C)F
|
| InChIKey |
BVZBYSWRTMMPAG-UHFFFAOYSA-N
|
| MW [Da] |
129.13
Automatically obtained from RDkit software. |
| LogP |
0.77
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM274175
Similarity: 0.8286
Similarity to MM274175
| Tanimoto metric | 0.8286 |
|---|---|
| Cosine metric | 0.9103 |
| Dice metric | 0.9063 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM103471
Similarity: 0.7931
Similarity to MM103471
| Tanimoto metric | 0.7931 |
|---|---|
| Cosine metric | 0.8906 |
| Dice metric | 0.8846 |
| MW: | 117.12 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM162734
Similarity: 0.7921
Similarity to MM162734
| Tanimoto metric | 0.7921 |
|---|---|
| Cosine metric | 0.8846 |
| Dice metric | 0.884 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+326 more
