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DocumentationIdentifier: MM288684
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM288684 |
| SMILES |
CC=CN=CNCC(C)C
|
| InChIKey |
SKLBNISQEVOHTH-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
1.79
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM456463
Similarity: 0.725
Similarity to MM456463
| Tanimoto metric | 0.725 |
|---|---|
| Cosine metric | 0.8407 |
| Dice metric | 0.8406 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM456594
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Similarity to MM456594
| Tanimoto metric | 0.7073 |
|---|---|
| Cosine metric | 0.8289 |
| Dice metric | 0.8286 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM456596
Similarity: 0.7073
Similarity to MM456596
| Tanimoto metric | 0.7073 |
|---|---|
| Cosine metric | 0.8289 |
| Dice metric | 0.8286 |
| MW: | 137.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+407 more
