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DocumentationIdentifier: MM318679
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM318679 |
| SMILES |
C=C(CF)CCC(=C)OC
|
| InChIKey |
FOYZPBLTHOMWEE-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
2.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144842
Similarity: 0.7315
Similarity to MM144842
| Tanimoto metric | 0.7315 |
|---|---|
| Cosine metric | 0.8553 |
| Dice metric | 0.8449 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM318678
Similarity: 0.6429
Similarity to MM318678
| Tanimoto metric | 0.6429 |
|---|---|
| Cosine metric | 0.7833 |
| Dice metric | 0.7826 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM318674
Similarity: 0.627
Similarity to MM318674
| Tanimoto metric | 0.627 |
|---|---|
| Cosine metric | 0.7718 |
| Dice metric | 0.7707 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+118 more
