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DocumentationIdentifier: MM366178
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM366178 |
| SMILES |
CN=CNCCC(C)CN
|
| InChIKey |
LGJTUFPDMNTGEF-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
0.22
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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MM165691
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| Tanimoto metric | 0.8406 |
|---|---|
| Cosine metric | 0.9168 |
| Dice metric | 0.9134 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM278527
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| Tanimoto metric | 0.8228 |
|---|---|
| Cosine metric | 0.9036 |
| Dice metric | 0.9028 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM291244
Similarity: 0.7733
Similarity to MM291244
| Tanimoto metric | 0.7733 |
|---|---|
| Cosine metric | 0.8728 |
| Dice metric | 0.8722 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+488 more
