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DocumentationIdentifier: MM397644
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM397644 |
| SMILES |
CC(C)=C(C=O)CC=CF
|
| InChIKey |
LZTGELCXKYJHRX-UHFFFAOYSA-N
|
| MW [Da] |
142.17
Automatically obtained from RDkit software. |
| LogP |
2.4
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM200386
Similarity: 0.8163
Similarity to MM200386
| Tanimoto metric | 0.8163 |
|---|---|
| Cosine metric | 0.9035 |
| Dice metric | 0.8989 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM383291
Similarity: 0.7345
Similarity to MM383291
| Tanimoto metric | 0.7345 |
|---|---|
| Cosine metric | 0.8469 |
| Dice metric | 0.8469 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM346364
Similarity: 0.7105
Similarity to MM346364
| Tanimoto metric | 0.7105 |
|---|---|
| Cosine metric | 0.8308 |
| Dice metric | 0.8308 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+274 more
