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DocumentationIdentifier: MM136346
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM136346 |
| SMILES |
C=CC=C(C)C=C(F)F
|
| InChIKey |
VWHRUPZEYKFRFX-UHFFFAOYSA-N
|
| MW [Da] |
130.14
Automatically obtained from RDkit software. |
| LogP |
2.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM253742
Similarity: 0.8356
Similarity to MM253742
| Tanimoto metric | 0.8356 |
|---|---|
| Cosine metric | 0.9104 |
| Dice metric | 0.9104 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM104895
Similarity: 0.8209
Similarity to MM104895
| Tanimoto metric | 0.8209 |
|---|---|
| Cosine metric | 0.906 |
| Dice metric | 0.9016 |
| MW: | 118.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM146766
Similarity: 0.7746
Similarity to MM146766
| Tanimoto metric | 0.7746 |
|---|---|
| Cosine metric | 0.8748 |
| Dice metric | 0.873 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+475 more
