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DocumentationIdentifier: MM292283
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292283 |
| SMILES |
C=CCOCC(=C)CC=C
|
| InChIKey |
ITYPRFXPJDUUBU-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.32
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156384
Similarity: 0.9333
Similarity to MM156384
| Tanimoto metric | 0.9333 |
|---|---|
| Cosine metric | 0.9661 |
| Dice metric | 0.9655 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292062
Similarity: 0.7778
Similarity to MM292062
| Tanimoto metric | 0.7778 |
|---|---|
| Cosine metric | 0.8767 |
| Dice metric | 0.875 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292063
Similarity: 0.7609
Similarity to MM292063
| Tanimoto metric | 0.7609 |
|---|---|
| Cosine metric | 0.8666 |
| Dice metric | 0.8642 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+436 more
