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DocumentationIdentifier: MM334258
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM334258 |
| SMILES |
C=CC(=CF)NC(=O)CC
|
| InChIKey |
VNUHRVVBESCHFV-UHFFFAOYSA-N
|
| MW [Da] |
143.16
Automatically obtained from RDkit software. |
| LogP |
1.51
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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MM150537
Similarity: 0.7721
Similarity to MM150537
| Tanimoto metric | 0.7721 |
|---|---|
| Cosine metric | 0.8787 |
| Dice metric | 0.8714 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM143110
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Similarity to MM143110
| Tanimoto metric | 0.7574 |
|---|---|
| Cosine metric | 0.8703 |
| Dice metric | 0.8619 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.34 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM142727
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Similarity to MM142727
| Tanimoto metric | 0.7279 |
|---|---|
| Cosine metric | 0.8532 |
| Dice metric | 0.8426 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+307 more
