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DocumentationIdentifier: MM222742
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM222742 |
| SMILES |
CC(C)(N)C=C(F)C(N)=O
|
| InChIKey |
ODTGJAFAHIBLMP-UHFFFAOYSA-N
|
| MW [Da] |
146.17
Automatically obtained from RDkit software. |
| LogP |
0.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM248063
Similarity: 0.6448
Similarity to MM248063
| Tanimoto metric | 0.6448 |
|---|---|
| Cosine metric | 0.7841 |
| Dice metric | 0.7841 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM248103
Similarity: 0.5876
Similarity to MM248103
| Tanimoto metric | 0.5876 |
|---|---|
| Cosine metric | 0.7419 |
| Dice metric | 0.7402 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM221630
Similarity: 0.5864
Similarity to MM221630
| Tanimoto metric | 0.5864 |
|---|---|
| Cosine metric | 0.7393 |
| Dice metric | 0.7393 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+142 more
