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DocumentationIdentifier: MM259366
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM259366 |
| SMILES |
C=C(C)C=COC(=O)CF
|
| InChIKey |
MCZJTZHCHFLYNG-UHFFFAOYSA-N
|
| MW [Da] |
144.15
Automatically obtained from RDkit software. |
| LogP |
1.59
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM168704
Similarity: 0.7477
Similarity to MM168704
| Tanimoto metric | 0.7477 |
|---|---|
| Cosine metric | 0.8647 |
| Dice metric | 0.8556 |
| MW: | 130.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM373450
Similarity: 0.6923
Similarity to MM373450
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8209 |
| Dice metric | 0.8182 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM85346
Similarity: 0.6777
Similarity to MM85346
| Tanimoto metric | 0.6777 |
|---|---|
| Cosine metric | 0.8091 |
| Dice metric | 0.8079 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+110 more
