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DocumentationIdentifier: MM246924
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM246924 |
| SMILES |
C=C(CC)OC(=C)C(=C)C
|
| InChIKey |
VSDSYLPBZPQMDL-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
3.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM246986
Similarity: 0.9135
Similarity to MM246986
| Tanimoto metric | 0.9135 |
|---|---|
| Cosine metric | 0.9548 |
| Dice metric | 0.9548 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM134056
Similarity: 0.91
Similarity to MM134056
| Tanimoto metric | 0.91 |
|---|---|
| Cosine metric | 0.9539 |
| Dice metric | 0.9529 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM142756
Similarity: 0.76
Similarity to MM142756
| Tanimoto metric | 0.76 |
|---|---|
| Cosine metric | 0.8718 |
| Dice metric | 0.8636 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+409 more
