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DocumentationIdentifier: MM256064
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM256064 |
| SMILES |
CC(=O)NC=C(F)C(C)C
|
| InChIKey |
QIKFJQJRJCQEIS-UHFFFAOYSA-N
|
| MW [Da] |
145.18
Automatically obtained from RDkit software. |
| LogP |
1.59
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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MM146644
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| Tanimoto metric | 0.8376 |
|---|---|
| Cosine metric | 0.9152 |
| Dice metric | 0.9116 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM253585
Similarity: 0.7313
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| Tanimoto metric | 0.7313 |
|---|---|
| Cosine metric | 0.8449 |
| Dice metric | 0.8448 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM253534
Similarity: 0.7259
Similarity to MM253534
| Tanimoto metric | 0.7259 |
|---|---|
| Cosine metric | 0.8412 |
| Dice metric | 0.8412 |
| MW: | 149.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+446 more
