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DocumentationIdentifier: MM253269
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM253269 |
| SMILES |
C=C(COC)OC=C(C)C
|
| InChIKey |
LKKKGWUULDTMNJ-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
2.09
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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MM146424
Similarity: 0.8353
Similarity to MM146424
| Tanimoto metric | 0.8353 |
|---|---|
| Cosine metric | 0.9139 |
| Dice metric | 0.9103 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM156903
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| Cosine metric | 0.901 |
| Dice metric | 0.8961 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.7 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM70135
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Similarity to MM70135
| Tanimoto metric | 0.7263 |
|---|---|
| Cosine metric | 0.842 |
| Dice metric | 0.8415 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+470 more
