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DocumentationIdentifier: MM295089
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM295089 |
| SMILES |
C=CCC(=C)C(=C)C=CC
|
| InChIKey |
TZYOOYPHUJJPSR-UHFFFAOYSA-N
|
| MW [Da] |
134.22
Automatically obtained from RDkit software. |
| LogP |
3.25
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM174478
Similarity: 0.8372
Similarity to MM174478
| Tanimoto metric | 0.8372 |
|---|---|
| Cosine metric | 0.915 |
| Dice metric | 0.9114 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM354090
Similarity: 0.8261
Similarity to MM354090
| Tanimoto metric | 0.8261 |
|---|---|
| Cosine metric | 0.905 |
| Dice metric | 0.9048 |
| MW: | 134.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM357044
Similarity: 0.74
Similarity to MM357044
| Tanimoto metric | 0.74 |
|---|---|
| Cosine metric | 0.8506 |
| Dice metric | 0.8506 |
| MW: | 134.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+485 more
