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DocumentationIdentifier: MM23517
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM23517 |
| SMILES |
C=CCF
|
| InChIKey |
QCMKXHXKNIOBBC-UHFFFAOYSA-N
|
| MW [Da] |
60.07
Automatically obtained from RDkit software. |
| LogP |
1.14
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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| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 74.1 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM23596
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| Cosine metric | 0.8165 |
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|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.44 |
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|---|---|---|---|---|---|
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Total active interactions
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MM25292
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|---|---|
| Cosine metric | 0.8165 |
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|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
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| LogP: | 1.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+75 more
