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DocumentationIdentifier: MM340730
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM340730 |
| SMILES |
CC(CN)OC1(CN)CC1
|
| InChIKey |
QKMMUESXBJRXMZ-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
-0.16
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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MM202846
Similarity: 0.9098
Similarity to MM202846
| Tanimoto metric | 0.9098 |
|---|---|
| Cosine metric | 0.9539 |
| Dice metric | 0.9528 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM348021
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| Tanimoto metric | 0.9077 |
|---|---|
| Cosine metric | 0.9517 |
| Dice metric | 0.9516 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM231168
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| Tanimoto metric | 0.9032 |
|---|---|
| Cosine metric | 0.9497 |
| Dice metric | 0.9492 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+431 more
