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DocumentationIdentifier: MM341918
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM341918 |
| SMILES |
CCC(=CF)OCC(C)O
|
| InChIKey |
AAUWGOBEXPLZRG-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
1.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM145268
Similarity: 0.7768
Similarity to MM145268
| Tanimoto metric | 0.7768 |
|---|---|
| Cosine metric | 0.8814 |
| Dice metric | 0.8744 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM411342
Similarity: 0.7073
Similarity to MM411342
| Tanimoto metric | 0.7073 |
|---|---|
| Cosine metric | 0.8304 |
| Dice metric | 0.8286 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM411254
Similarity: 0.6803
Similarity to MM411254
| Tanimoto metric | 0.6803 |
|---|---|
| Cosine metric | 0.8133 |
| Dice metric | 0.8098 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+500 more
