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DocumentationIdentifier: MM275300
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM275300 |
| SMILES |
C=C(C)C(CF)CC(C)=O
|
| InChIKey |
AZTMBYBJYYRRBP-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
2.13
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM377536
Similarity: 0.7103
Similarity to MM377536
| Tanimoto metric | 0.7103 |
|---|---|
| Cosine metric | 0.8328 |
| Dice metric | 0.8306 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM179855
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| Tanimoto metric | 0.6842 |
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| Cosine metric | 0.8272 |
| Dice metric | 0.8125 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM149987
Similarity: 0.6767
Similarity to MM149987
| Tanimoto metric | 0.6767 |
|---|---|
| Cosine metric | 0.8226 |
| Dice metric | 0.8072 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+262 more
