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DocumentationIdentifier: MM146644
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM146644 |
| SMILES |
CCC(F)=CNC(C)=O
|
| InChIKey |
LMNOGUOHLFEYQS-UHFFFAOYSA-N
|
| MW [Da] |
131.15
Automatically obtained from RDkit software. |
| LogP |
1.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM253585
Similarity: 0.8522
Similarity to MM253585
| Tanimoto metric | 0.8522 |
|---|---|
| Cosine metric | 0.9231 |
| Dice metric | 0.9202 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM253534
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| Tanimoto metric | 0.8448 |
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| Cosine metric | 0.9191 |
| Dice metric | 0.9159 |
| MW: | 149.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM253586
Similarity: 0.8376
Similarity to MM253586
| Tanimoto metric | 0.8376 |
|---|---|
| Cosine metric | 0.9152 |
| Dice metric | 0.9116 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+583 more
