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DocumentationIdentifier: MM238258
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM238258 |
| SMILES |
CNC=CC(=O)C=C(F)F
|
| InChIKey |
VBYQJCPNJYCXIT-UHFFFAOYSA-N
|
| MW [Da] |
147.12
Automatically obtained from RDkit software. |
| LogP |
1.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM158208
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Similarity to MM158208
| Tanimoto metric | 0.8065 |
|---|---|
| Cosine metric | 0.898 |
| Dice metric | 0.8929 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM282404
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| Tanimoto metric | 0.6757 |
|---|---|
| Cosine metric | 0.8065 |
| Dice metric | 0.8065 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM34202
Similarity: 0.6129
Similarity to MM34202
| Tanimoto metric | 0.6129 |
|---|---|
| Cosine metric | 0.7829 |
| Dice metric | 0.76 |
| MW: | 115.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+180 more
