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DocumentationIdentifier: MM38189
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM38189 |
| SMILES |
C=C(F)CNCC=O
|
| InChIKey |
WYLPGQCEXFAJAD-UHFFFAOYSA-N
|
| MW [Da] |
117.12
Automatically obtained from RDkit software. |
| LogP |
0.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM35510
Similarity: 0.6867
Similarity to MM35510
| Tanimoto metric | 0.6867 |
|---|---|
| Cosine metric | 0.8287 |
| Dice metric | 0.8143 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Tanimoto metric | 0.6867 |
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| Cosine metric | 0.8287 |
| Dice metric | 0.8143 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.6 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM412232
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| Tanimoto metric | 0.6333 |
|---|---|
| Cosine metric | 0.7958 |
| Dice metric | 0.7755 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+78 more
