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DocumentationIdentifier: MM387970
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM387970 |
| SMILES |
C=CCC(CF)CC=CF
|
| InChIKey |
IMHNSYWGALTBOU-UHFFFAOYSA-N
|
| MW [Da] |
146.18
Automatically obtained from RDkit software. |
| LogP |
3.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM199418
Similarity: 0.9155
Similarity to MM199418
| Tanimoto metric | 0.9155 |
|---|---|
| Cosine metric | 0.9568 |
| Dice metric | 0.9559 |
| MW: | 134.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM345754
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| Tanimoto metric | 0.7558 |
|---|---|
| Cosine metric | 0.8625 |
| Dice metric | 0.8609 |
| MW: | 152.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM393740
Similarity: 0.7386
Similarity to MM393740
| Tanimoto metric | 0.7386 |
|---|---|
| Cosine metric | 0.8519 |
| Dice metric | 0.8497 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+576 more
