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DocumentationIdentifier: MM304650
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM304650 |
| SMILES |
C#CC=C(C=CF)CCF
|
| InChIKey |
NUADCFTXRSWHHK-UHFFFAOYSA-N
|
| MW [Da] |
142.15
Automatically obtained from RDkit software. |
| LogP |
2.39
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM179182
Similarity: 0.7706
Similarity to MM179182
| Tanimoto metric | 0.7706 |
|---|---|
| Cosine metric | 0.8779 |
| Dice metric | 0.8705 |
| MW: | 124.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM179437
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Similarity to MM179437
| Tanimoto metric | 0.7706 |
|---|---|
| Cosine metric | 0.8779 |
| Dice metric | 0.8705 |
| MW: | 124.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM274242
Similarity: 0.6614
Similarity to MM274242
| Tanimoto metric | 0.6614 |
|---|---|
| Cosine metric | 0.7966 |
| Dice metric | 0.7962 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+345 more
