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DocumentationIdentifier: MM247384
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM247384 |
| SMILES |
C=CC(F)=CC(F)C(C)C
|
| InChIKey |
KVXHPNAVRGTMRV-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 |
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MM143380
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| Tanimoto metric | 0.7949 |
|---|---|
| Cosine metric | 0.8916 |
| Dice metric | 0.8857 |
| MW: | 132.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM266484
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| Tanimoto metric | 0.7037 |
|---|---|
| Cosine metric | 0.8262 |
| Dice metric | 0.8261 |
| MW: | 150.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM267909
Similarity: 0.6889
Similarity to MM267909
| Tanimoto metric | 0.6889 |
|---|---|
| Cosine metric | 0.8161 |
| Dice metric | 0.8158 |
| MW: | 146.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+430 more
