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DocumentationIdentifier: MM376085
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM376085 |
| SMILES |
C=CC(C)C(CF)CCF
|
| InChIKey |
AAJITDQHXZSEKA-UHFFFAOYSA-N
|
| MW [Da] |
148.2
Automatically obtained from RDkit software. |
| LogP |
2.75
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM406670
Similarity: 0.7835
Similarity to MM406670
| Tanimoto metric | 0.7835 |
|---|---|
| Cosine metric | 0.8786 |
| Dice metric | 0.8786 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376502
Similarity: 0.7755
Similarity to MM376502
| Tanimoto metric | 0.7755 |
|---|---|
| Cosine metric | 0.8736 |
| Dice metric | 0.8736 |
| MW: | 142.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM196924
Similarity: 0.764
Similarity to MM196924
| Tanimoto metric | 0.764 |
|---|---|
| Cosine metric | 0.8714 |
| Dice metric | 0.8662 |
| MW: | 130.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+673 more
