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DocumentationIdentifier: MM200202
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM200202 |
| SMILES |
O=CC(C=O)NC(=O)CF
|
| InChIKey |
ZCUJOZKQFASESH-UHFFFAOYSA-N
|
| MW [Da] |
147.11
Automatically obtained from RDkit software. |
| LogP |
-1.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM104364
Similarity: 0.6452
Similarity to MM104364
| Tanimoto metric | 0.6452 |
|---|---|
| Cosine metric | 0.8032 |
| Dice metric | 0.7843 |
| MW: | 115.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM113211
Similarity: 0.6344
Similarity to MM113211
| Tanimoto metric | 0.6344 |
|---|---|
| Cosine metric | 0.7965 |
| Dice metric | 0.7763 |
| MW: | 119.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM349602
Similarity: 0.6214
Similarity to MM349602
| Tanimoto metric | 0.6214 |
|---|---|
| Cosine metric | 0.7793 |
| Dice metric | 0.7665 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | |||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+117 more
