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DocumentationIdentifier: MM278668
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM278668 |
| SMILES |
C=COC(C)COC=CC
|
| InChIKey |
IXVPGOIEWHWTQT-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 |
Similar entries
MM167207
Similarity: 0.9178
Similarity to MM167207
| Tanimoto metric | 0.9178 |
|---|---|
| Cosine metric | 0.958 |
| Dice metric | 0.9571 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM367708
Similarity: 0.8171
Similarity to MM367708
| Tanimoto metric | 0.8171 |
|---|---|
| Cosine metric | 0.8995 |
| Dice metric | 0.8993 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM368000
Similarity: 0.7816
Similarity to MM368000
| Tanimoto metric | 0.7816 |
|---|---|
| Cosine metric | 0.8789 |
| Dice metric | 0.8774 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+724 more
