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DocumentationIdentifier: MM280075
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM280075 |
| SMILES |
COCC(=O)NC=CCF
|
| InChIKey |
PTLMMZHSFWGXGF-UHFFFAOYSA-N
|
| MW [Da] |
147.15
Automatically obtained from RDkit software. |
| LogP |
0.23
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM280074
Similarity: 0.7436
Similarity to MM280074
| Tanimoto metric | 0.7436 |
|---|---|
| Cosine metric | 0.8531 |
| Dice metric | 0.8529 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM70159
Similarity: 0.735
Similarity to MM70159
| Tanimoto metric | 0.735 |
|---|---|
| Cosine metric | 0.8475 |
| Dice metric | 0.8473 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM259100
Similarity: 0.735
Similarity to MM259100
| Tanimoto metric | 0.735 |
|---|---|
| Cosine metric | 0.8475 |
| Dice metric | 0.8473 |
| MW: | 151.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+430 more
