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DocumentationIdentifier: MM357218
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM357218 |
| SMILES |
CCOCC(F)C=CCO
|
| InChIKey |
KGEGEDVBMCCZHQ-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
0.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM279166
Similarity: 0.798
Similarity to MM279166
| Tanimoto metric | 0.798 |
|---|---|
| Cosine metric | 0.8877 |
| Dice metric | 0.8876 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279080
Similarity: 0.7938
Similarity to MM279080
| Tanimoto metric | 0.7938 |
|---|---|
| Cosine metric | 0.8856 |
| Dice metric | 0.8851 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279082
Similarity: 0.7404
Similarity to MM279082
| Tanimoto metric | 0.7404 |
|---|---|
| Cosine metric | 0.8508 |
| Dice metric | 0.8508 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+480 more
