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DocumentationIdentifier: MM326133
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM326133 |
| SMILES |
C=CC(C)=CC=C(C)OC
|
| InChIKey |
SJWBYQNXHCKKIB-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.67
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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MM146754
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| Tanimoto metric | 0.7753 |
|---|---|
| Cosine metric | 0.8805 |
| Dice metric | 0.8734 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM171484
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| Tanimoto metric | 0.6966 |
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| Cosine metric | 0.8346 |
| Dice metric | 0.8212 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM371646
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Similarity to MM371646
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.809 |
| Dice metric | 0.8 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+326 more
