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DocumentationIdentifier: MM224270
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM224270 |
| SMILES |
C=CC(C#N)NC(C)(C)C
|
| InChIKey |
SAWFWAWYWIKFBF-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM26847
Similarity: 0.7717
Similarity to MM26847
| Tanimoto metric | 0.7717 |
|---|---|
| Cosine metric | 0.8716 |
| Dice metric | 0.8712 |
| MW: | 135.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM226467
Similarity: 0.7708
Similarity to MM226467
| Tanimoto metric | 0.7708 |
|---|---|
| Cosine metric | 0.8706 |
| Dice metric | 0.8706 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM229171
Similarity: 0.7547
Similarity to MM229171
| Tanimoto metric | 0.7547 |
|---|---|
| Cosine metric | 0.8643 |
| Dice metric | 0.8602 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+255 more
