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DocumentationIdentifier: MM328426
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM328426 |
| SMILES |
CCC(CC)CC(=N)NC
|
| InChIKey |
JAWWUDVGTRHMQJ-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
2.01
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141961
Similarity: 0.931
Similarity to MM141961
| Tanimoto metric | 0.931 |
|---|---|
| Cosine metric | 0.9649 |
| Dice metric | 0.9643 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM244931
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| Tanimoto metric | 0.7714 |
|---|---|
| Cosine metric | 0.8728 |
| Dice metric | 0.871 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM226690
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Similarity to MM226690
| Tanimoto metric | 0.7714 |
|---|---|
| Cosine metric | 0.8728 |
| Dice metric | 0.871 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+713 more
