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DocumentationIdentifier: MM295585
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM295585 |
| SMILES |
CC(CF)=C(C)CNC=O
|
| InChIKey |
FOUXYORABSKSCG-UHFFFAOYSA-N
|
| MW [Da] |
145.18
Automatically obtained from RDkit software. |
| LogP |
1.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM282296
Similarity: 0.79
Similarity to MM282296
| Tanimoto metric | 0.79 |
|---|---|
| Cosine metric | 0.8888 |
| Dice metric | 0.8827 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM295638
Similarity: 0.7759
Similarity to MM295638
| Tanimoto metric | 0.7759 |
|---|---|
| Cosine metric | 0.8742 |
| Dice metric | 0.8738 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM171062
Similarity: 0.71
Similarity to MM171062
| Tanimoto metric | 0.71 |
|---|---|
| Cosine metric | 0.8426 |
| Dice metric | 0.8304 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+221 more
