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DocumentationIdentifier: MM223094
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM223094 |
| SMILES |
CC(C)CC(C)CC(=N)N
|
| InChIKey |
JLZRDWRAXAZGSM-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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MM135167
Similarity: 0.8875
Similarity to MM135167
| Tanimoto metric | 0.8875 |
|---|---|
| Cosine metric | 0.9421 |
| Dice metric | 0.9404 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236551
Similarity: 0.8256
Similarity to MM236551
| Tanimoto metric | 0.8256 |
|---|---|
| Cosine metric | 0.9046 |
| Dice metric | 0.9045 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM268429
Similarity: 0.7396
Similarity to MM268429
| Tanimoto metric | 0.7396 |
|---|---|
| Cosine metric | 0.851 |
| Dice metric | 0.8503 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+433 more
