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DocumentationIdentifier: MM416722
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM416722 |
| SMILES |
C=CC(=CC)CCC=CC
|
| InChIKey |
PCTXGTHDHFPIRH-UHFFFAOYSA-N
|
| MW [Da] |
136.24
Automatically obtained from RDkit software. |
| LogP |
3.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM200126
Similarity: 0.8889
Similarity to MM200126
| Tanimoto metric | 0.8889 |
|---|---|
| Cosine metric | 0.9428 |
| Dice metric | 0.9412 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM382157
Similarity: 0.85
Similarity to MM382157
| Tanimoto metric | 0.85 |
|---|---|
| Cosine metric | 0.9193 |
| Dice metric | 0.9189 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM377168
Similarity: 0.8095
Similarity to MM377168
| Tanimoto metric | 0.8095 |
|---|---|
| Cosine metric | 0.896 |
| Dice metric | 0.8947 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+413 more
