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DocumentationIdentifier: MM376998
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM376998 |
| SMILES |
C#CCC(=CF)OC=CF
|
| InChIKey |
UVAFZRZYBKZDJU-UHFFFAOYSA-N
|
| MW [Da] |
144.12
Automatically obtained from RDkit software. |
| LogP |
2.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM200361
Similarity: 0.7767
Similarity to MM200361
| Tanimoto metric | 0.7767 |
|---|---|
| Cosine metric | 0.8813 |
| Dice metric | 0.8743 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376996
Similarity: 0.7355
Similarity to MM376996
| Tanimoto metric | 0.7355 |
|---|---|
| Cosine metric | 0.8478 |
| Dice metric | 0.8476 |
| MW: | 140.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM273256
Similarity: 0.7209
Similarity to MM273256
| Tanimoto metric | 0.7209 |
|---|---|
| Cosine metric | 0.84 |
| Dice metric | 0.8378 |
| MW: | 140.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+260 more
