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DocumentationIdentifier: MM348462
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM348462 |
| SMILES |
C#CC(O)C(N)C(C)CF
|
| InChIKey |
LZDZZMSURZRGMJ-UHFFFAOYSA-N
|
| MW [Da] |
145.18
Automatically obtained from RDkit software. |
| LogP |
-0.09
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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MM77083
Similarity: 0.731
Similarity to MM77083
| Tanimoto metric | 0.731 |
|---|---|
| Cosine metric | 0.855 |
| Dice metric | 0.8446 |
| MW: | 135.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160068
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Similarity to MM160068
| Tanimoto metric | 0.6897 |
|---|---|
| Cosine metric | 0.8305 |
| Dice metric | 0.8163 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM348153
Similarity: 0.6199
Similarity to MM348153
| Tanimoto metric | 0.6199 |
|---|---|
| Cosine metric | 0.7662 |
| Dice metric | 0.7653 |
| MW: | 153.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+301 more
