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DocumentationIdentifier: MM228784
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM228784 |
| SMILES |
CC(F)=CCC(C)(O)C=O
|
| InChIKey |
VIORKNIMIRVZMT-UHFFFAOYSA-N
|
| MW [Da] |
146.16
Automatically obtained from RDkit software. |
| LogP |
1.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM130552
Similarity: 0.6641
Similarity to MM130552
| Tanimoto metric | 0.6641 |
|---|---|
| Cosine metric | 0.8149 |
| Dice metric | 0.7981 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM77530
Similarity: 0.6549
Similarity to MM77530
| Tanimoto metric | 0.6549 |
|---|---|
| Cosine metric | 0.7947 |
| Dice metric | 0.7915 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM240476
Similarity: 0.6522
Similarity to MM240476
| Tanimoto metric | 0.6522 |
|---|---|
| Cosine metric | 0.7955 |
| Dice metric | 0.7895 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+277 more
