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DocumentationIdentifier: MM236782
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM236782 |
| SMILES |
C=CCCC(=O)CC(F)F
|
| InChIKey |
YXNFUZHWZDDOAZ-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
MM156222
Similarity: 0.8095
Similarity to MM156222
| Tanimoto metric | 0.8095 |
|---|---|
| Cosine metric | 0.8997 |
| Dice metric | 0.8947 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236718
Similarity: 0.7111
Similarity to MM236718
| Tanimoto metric | 0.7111 |
|---|---|
| Cosine metric | 0.8346 |
| Dice metric | 0.8312 |
| MW: | 154.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236716
Similarity: 0.6882
Similarity to MM236716
| Tanimoto metric | 0.6882 |
|---|---|
| Cosine metric | 0.8173 |
| Dice metric | 0.8153 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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