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DocumentationIdentifier: MM245596
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM245596 |
| SMILES |
C=C(F)C(C)CC(=O)CF
|
| InChIKey |
RNPWEWWUCDOPCU-UHFFFAOYSA-N
|
| MW [Da] |
148.15
Automatically obtained from RDkit software. |
| LogP |
2.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133703
Similarity: 0.816
Similarity to MM133703
| Tanimoto metric | 0.816 |
|---|---|
| Cosine metric | 0.9033 |
| Dice metric | 0.8987 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245827
Similarity: 0.7606
Similarity to MM245827
| Tanimoto metric | 0.7606 |
|---|---|
| Cosine metric | 0.864 |
| Dice metric | 0.864 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM329172
Similarity: 0.7481
Similarity to MM329172
| Tanimoto metric | 0.7481 |
|---|---|
| Cosine metric | 0.8574 |
| Dice metric | 0.8559 |
| MW: | 148.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+174 more
