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DocumentationIdentifier: MM289413
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM289413 |
| SMILES |
CC(F)C=COC=CCN
|
| InChIKey |
AEEPRIDAAMTQAG-UHFFFAOYSA-N
|
| MW [Da] |
145.18
Automatically obtained from RDkit software. |
| LogP |
1.35
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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MM154257
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| Tanimoto metric | 0.8169 |
|---|---|
| Cosine metric | 0.9038 |
| Dice metric | 0.8992 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM106255
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| Tanimoto metric | 0.7324 |
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| Cosine metric | 0.8558 |
| Dice metric | 0.8455 |
| MW: | 116.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM364914
Similarity: 0.6824
Similarity to MM364914
| Tanimoto metric | 0.6824 |
|---|---|
| Cosine metric | 0.8112 |
| Dice metric | 0.8112 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+444 more
