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DocumentationIdentifier: MM285257
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM285257 |
| SMILES |
C=CCC(F)=CC=CCC
|
| InChIKey |
CLLKPHZARPCHFK-UHFFFAOYSA-N
|
| MW [Da] |
140.2
Automatically obtained from RDkit software. |
| LogP |
3.38
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM159696
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Similarity to MM159696
| Tanimoto metric | 0.9155 |
|---|---|
| Cosine metric | 0.9568 |
| Dice metric | 0.9559 |
| MW: | 126.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM171430
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| Tanimoto metric | 0.831 |
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| Cosine metric | 0.9116 |
| Dice metric | 0.9077 |
| MW: | 128.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM159097
Similarity: 0.8
Similarity to MM159097
| Tanimoto metric | 0.8 |
|---|---|
| Cosine metric | 0.8901 |
| Dice metric | 0.8889 |
| MW: | 126.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+617 more
