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DocumentationIdentifier: MM150555
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM150555 |
| SMILES |
C=CC(=CC)OC(=C)C
|
| InChIKey |
QASOPUFRYOGZRC-UHFFFAOYSA-N
|
| MW [Da] |
124.18
Automatically obtained from RDkit software. |
| LogP |
2.63
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM334467
Similarity: 0.9149
Similarity to MM334467
| Tanimoto metric | 0.9149 |
|---|---|
| Cosine metric | 0.9565 |
| Dice metric | 0.9556 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM334990
Similarity: 0.9053
Similarity to MM334990
| Tanimoto metric | 0.9053 |
|---|---|
| Cosine metric | 0.9515 |
| Dice metric | 0.9503 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM143196
Similarity: 0.8352
Similarity to MM143196
| Tanimoto metric | 0.8352 |
|---|---|
| Cosine metric | 0.9106 |
| Dice metric | 0.9102 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+439 more
