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DocumentationIdentifier: MM354617
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM354617 |
| SMILES |
CCC(=O)C(F)=C(C)CF
|
| InChIKey |
JWEVLJUGCZAVIQ-UHFFFAOYSA-N
|
| MW [Da] |
148.15
Automatically obtained from RDkit software. |
| LogP |
2.18
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM161808
Similarity: 0.7483
Similarity to MM161808
| Tanimoto metric | 0.7483 |
|---|---|
| Cosine metric | 0.8651 |
| Dice metric | 0.8561 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM161612
Similarity: 0.7086
Similarity to MM161612
| Tanimoto metric | 0.7086 |
|---|---|
| Cosine metric | 0.8418 |
| Dice metric | 0.8295 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM301044
Similarity: 0.6826
Similarity to MM301044
| Tanimoto metric | 0.6826 |
|---|---|
| Cosine metric | 0.8137 |
| Dice metric | 0.8114 |
| MW: | 148.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+301 more
