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DocumentationIdentifier: MM264251
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM264251 |
| SMILES |
C#CC(=O)CC(F)C=CC
|
| InChIKey |
GTUAPUKTNYJCRQ-UHFFFAOYSA-N
|
| MW [Da] |
140.16
Automatically obtained from RDkit software. |
| LogP |
1.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142428
Similarity: 0.8049
Similarity to MM142428
| Tanimoto metric | 0.8049 |
|---|---|
| Cosine metric | 0.8971 |
| Dice metric | 0.8919 |
| MW: | 126.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264252
Similarity: 0.6918
Similarity to MM264252
| Tanimoto metric | 0.6918 |
|---|---|
| Cosine metric | 0.8178 |
| Dice metric | 0.8178 |
| MW: | 144.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264803
Similarity: 0.6781
Similarity to MM264803
| Tanimoto metric | 0.6781 |
|---|---|
| Cosine metric | 0.8082 |
| Dice metric | 0.8082 |
| MW: | 140.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+227 more
