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DocumentationIdentifier: MM324350
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM324350 |
| SMILES |
CC1(OC(CN)CN)CC1
|
| InChIKey |
DIPQVKLEGVCRKF-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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MM149184
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| Tanimoto metric | 0.9327 |
|---|---|
| Cosine metric | 0.9658 |
| Dice metric | 0.9652 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Tanimoto metric | 0.8509 |
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| Cosine metric | 0.9195 |
| Dice metric | 0.9194 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM324346
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Similarity to MM324346
| Tanimoto metric | 0.8151 |
|---|---|
| Cosine metric | 0.8988 |
| Dice metric | 0.8981 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+418 more
