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DocumentationIdentifier: MM130637
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM130637 |
| SMILES |
CC(C)NC(C)(C)CF
|
| InChIKey |
AWKFNAAVHGFFNK-UHFFFAOYSA-N
|
| MW [Da] |
133.21
Automatically obtained from RDkit software. |
| LogP |
1.73
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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MM220632
Similarity: 0.9683
Similarity to MM220632
| Tanimoto metric | 0.9683 |
|---|---|
| Cosine metric | 0.984 |
| Dice metric | 0.9839 |
| MW: | 147.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM102981
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Similarity to MM102981
| Tanimoto metric | 0.8689 |
|---|---|
| Cosine metric | 0.9321 |
| Dice metric | 0.9298 |
| MW: | 119.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM130028
Similarity: 0.8413
Similarity to MM130028
| Tanimoto metric | 0.8413 |
|---|---|
| Cosine metric | 0.915 |
| Dice metric | 0.9138 |
| MW: | 133.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+437 more
