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DocumentationIdentifier: MM222813
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM222813 |
| SMILES |
CC(C)(C)C(C)(C)C(=N)N
|
| InChIKey |
WZUYJFNOGRVSEG-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
1.99
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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MM132902
Similarity: 0.871
Similarity to MM132902
| Tanimoto metric | 0.871 |
|---|---|
| Cosine metric | 0.9333 |
| Dice metric | 0.931 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM129848
Similarity: 0.8172
Similarity to MM129848
| Tanimoto metric | 0.8172 |
|---|---|
| Cosine metric | 0.904 |
| Dice metric | 0.8994 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.6 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM244350
Similarity: 0.6807
Similarity to MM244350
| Tanimoto metric | 0.6807 |
|---|---|
| Cosine metric | 0.812 |
| Dice metric | 0.81 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+321 more
