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DocumentationIdentifier: MM352551
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM352551 |
| SMILES |
C#CC(=C)C(=C)OCC=C
|
| InChIKey |
FAQPCLNDMAHLDJ-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
1.89
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM173902
Similarity: 0.8824
Similarity to MM173902
| Tanimoto metric | 0.8824 |
|---|---|
| Cosine metric | 0.9393 |
| Dice metric | 0.9375 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM352510
Similarity: 0.8583
Similarity to MM352510
| Tanimoto metric | 0.8583 |
|---|---|
| Cosine metric | 0.9238 |
| Dice metric | 0.9237 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM352562
Similarity: 0.7852
Similarity to MM352562
| Tanimoto metric | 0.7852 |
|---|---|
| Cosine metric | 0.8797 |
| Dice metric | 0.8797 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+61 more
