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DocumentationIdentifier: MM278814
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM278814 |
| SMILES |
C=CCC(=O)CCC=CF
|
| InChIKey |
DVGJPNZVBFLQSO-UHFFFAOYSA-N
|
| MW [Da] |
142.17
Automatically obtained from RDkit software. |
| LogP |
2.4
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM167377
Similarity: 0.9014
Similarity to MM167377
| Tanimoto metric | 0.9014 |
|---|---|
| Cosine metric | 0.9494 |
| Dice metric | 0.9481 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM356724
Similarity: 0.8701
Similarity to MM356724
| Tanimoto metric | 0.8701 |
|---|---|
| Cosine metric | 0.9306 |
| Dice metric | 0.9306 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM156821
Similarity: 0.7922
Similarity to MM156821
| Tanimoto metric | 0.7922 |
|---|---|
| Cosine metric | 0.8844 |
| Dice metric | 0.8841 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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