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DocumentationIdentifier: MM331252
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM331252 |
| SMILES |
C=CC(C=C)CC(C)=CC
|
| InChIKey |
QIKQDWIWLRLFOP-UHFFFAOYSA-N
|
| MW [Da] |
136.24
Automatically obtained from RDkit software. |
| LogP |
3.33
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142952
Similarity: 0.8734
Similarity to MM142952
| Tanimoto metric | 0.8734 |
|---|---|
| Cosine metric | 0.9346 |
| Dice metric | 0.9324 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265558
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| Tanimoto metric | 0.7753 |
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| Cosine metric | 0.8734 |
| Dice metric | 0.8734 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM248374
Similarity: 0.7419
Similarity to MM248374
| Tanimoto metric | 0.7419 |
|---|---|
| Cosine metric | 0.8521 |
| Dice metric | 0.8519 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+174 more
