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DocumentationIdentifier: MM228085
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM228085 |
| SMILES |
C=C(C)COC(C)(C)CO
|
| InChIKey |
VIYJKNBZRRVSLZ-UHFFFAOYSA-N
|
| MW [Da] |
144.21
Automatically obtained from RDkit software. |
| LogP |
1.35
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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MM138300
Similarity: 0.7333
Similarity to MM138300
| Tanimoto metric | 0.7333 |
|---|---|
| Cosine metric | 0.8563 |
| Dice metric | 0.8462 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM316864
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| Tanimoto metric | 0.6961 |
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| Cosine metric | 0.8215 |
| Dice metric | 0.8208 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM138181
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Similarity to MM138181
| Tanimoto metric | 0.6778 |
|---|---|
| Cosine metric | 0.8233 |
| Dice metric | 0.8079 |
| MW: | 132.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+396 more
