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DocumentationIdentifier: MM372578
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM372578 |
| SMILES |
C=COC=COC(C)CO
|
| InChIKey |
WPXHMZVWBPPYFW-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
1.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM48957
Similarity: 0.8806
Similarity to MM48957
| Tanimoto metric | 0.8806 |
|---|---|
| Cosine metric | 0.9384 |
| Dice metric | 0.9365 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372409
Similarity: 0.8551
Similarity to MM372409
| Tanimoto metric | 0.8551 |
|---|---|
| Cosine metric | 0.9229 |
| Dice metric | 0.9219 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279754
Similarity: 0.7692
Similarity to MM279754
| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.8699 |
| Dice metric | 0.8696 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+400 more
