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DocumentationIdentifier: MM316342
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM316342 |
| SMILES |
CCC(F)CCC(=O)CF
|
| InChIKey |
KJIUXWSKSIXVON-UHFFFAOYSA-N
|
| MW [Da] |
150.17
Automatically obtained from RDkit software. |
| LogP |
2.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144255
Similarity: 0.7791
Similarity to MM144255
| Tanimoto metric | 0.7791 |
|---|---|
| Cosine metric | 0.8826 |
| Dice metric | 0.8758 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM250620
Similarity: 0.7444
Similarity to MM250620
| Tanimoto metric | 0.7444 |
|---|---|
| Cosine metric | 0.8574 |
| Dice metric | 0.8535 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM250621
Similarity: 0.7396
Similarity to MM250621
| Tanimoto metric | 0.7396 |
|---|---|
| Cosine metric | 0.8507 |
| Dice metric | 0.8503 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+387 more
