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DocumentationIdentifier: MM312291
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM312291 |
| SMILES |
C#CC(F)(C#C)C#CCC
|
| InChIKey |
HOFMZRJMYIWHRA-UHFFFAOYSA-N
|
| MW [Da] |
134.15
Automatically obtained from RDkit software. |
| LogP |
1.37
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM139137
Similarity: 0.9211
Similarity to MM139137
| Tanimoto metric | 0.9211 |
|---|---|
| Cosine metric | 0.9597 |
| Dice metric | 0.9589 |
| MW: | 124.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM241628
Similarity: 0.8537
Similarity to MM241628
| Tanimoto metric | 0.8537 |
|---|---|
| Cosine metric | 0.9211 |
| Dice metric | 0.9211 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM228574
Similarity: 0.8333
Similarity to MM228574
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9092 |
| Dice metric | 0.9091 |
| MW: | 138.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+212 more
