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DocumentationIdentifier: MM369660
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM369660 |
| SMILES |
C#CC=CC#CC(F)=CF
|
| InChIKey |
UYHUTNVBCBYMQB-UHFFFAOYSA-N
|
| MW [Da] |
138.12
Automatically obtained from RDkit software. |
| LogP |
1.96
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM170936
Similarity: 0.8947
Similarity to MM170936
| Tanimoto metric | 0.8947 |
|---|---|
| Cosine metric | 0.9459 |
| Dice metric | 0.9444 |
| MW: | 128.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM369638
Similarity: 0.7907
Similarity to MM369638
| Tanimoto metric | 0.7907 |
|---|---|
| Cosine metric | 0.8832 |
| Dice metric | 0.8831 |
| MW: | 140.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM369602
Similarity: 0.7556
Similarity to MM369602
| Tanimoto metric | 0.7556 |
|---|---|
| Cosine metric | 0.8614 |
| Dice metric | 0.8608 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+285 more
