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DocumentationIdentifier: MM282466
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM282466 |
| SMILES |
CC=CC=CC(=O)C=CC
|
| InChIKey |
KCDQKZLJXZGKAX-UHFFFAOYSA-N
|
| MW [Da] |
136.19
Automatically obtained from RDkit software. |
| LogP |
2.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM170230
Similarity: 0.9667
Similarity to MM170230
| Tanimoto metric | 0.9667 |
|---|---|
| Cosine metric | 0.9832 |
| Dice metric | 0.9831 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM366314
Similarity: 0.9063
Similarity to MM366314
| Tanimoto metric | 0.9063 |
|---|---|
| Cosine metric | 0.9509 |
| Dice metric | 0.9508 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM366370
Similarity: 0.9063
Similarity to MM366370
| Tanimoto metric | 0.9063 |
|---|---|
| Cosine metric | 0.9509 |
| Dice metric | 0.9508 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+388 more
