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DocumentationIdentifier: MM266536
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM266536 |
| SMILES |
C#CCC(=O)C1NC1CF
|
| InChIKey |
BAYJZMWBZMJLDA-UHFFFAOYSA-N
|
| MW [Da] |
141.15
Automatically obtained from RDkit software. |
| LogP |
-0.11
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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MM368678
Similarity: 0.7531
Similarity to MM368678
| Tanimoto metric | 0.7531 |
|---|---|
| Cosine metric | 0.8601 |
| Dice metric | 0.8592 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM263586
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| Tanimoto metric | 0.7397 |
|---|---|
| Cosine metric | 0.8601 |
| Dice metric | 0.8504 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM150212
Similarity: 0.6885
Similarity to MM150212
| Tanimoto metric | 0.6885 |
|---|---|
| Cosine metric | 0.8155 |
| Dice metric | 0.8155 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+64 more
