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DocumentationIdentifier: MM296281
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM296281 |
| SMILES |
CCNC(=O)C(F)=CCO
|
| InChIKey |
JCKPFFDHHFYJFE-UHFFFAOYSA-N
|
| MW [Da] |
147.15
Automatically obtained from RDkit software. |
| LogP |
-0.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM51088
Similarity: 0.8406
Similarity to MM51088
| Tanimoto metric | 0.8406 |
|---|---|
| Cosine metric | 0.9168 |
| Dice metric | 0.9134 |
| MW: | 133.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM300732
Similarity: 0.7222
Similarity to MM300732
| Tanimoto metric | 0.7222 |
|---|---|
| Cosine metric | 0.8388 |
| Dice metric | 0.8387 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM85654
Similarity: 0.7152
Similarity to MM85654
| Tanimoto metric | 0.7152 |
|---|---|
| Cosine metric | 0.8341 |
| Dice metric | 0.8339 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+167 more
