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DocumentationIdentifier: MM223116
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM223116 |
| SMILES |
O=C(O)CC(F)CC(F)F
|
| InChIKey |
ZHKQLWRJLNMJNJ-UHFFFAOYSA-N
|
| MW [Da] |
156.1
Automatically obtained from RDkit software. |
| LogP |
1.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133015
Similarity: 0.6355
Similarity to MM133015
| Tanimoto metric | 0.6355 |
|---|---|
| Cosine metric | 0.7972 |
| Dice metric | 0.7771 |
| MW: | 138.11 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM32933
Similarity: 0.6262
Similarity to MM32933
| Tanimoto metric | 0.6262 |
|---|---|
| Cosine metric | 0.7913 |
| Dice metric | 0.7701 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268480
Similarity: 0.6241
Similarity to MM268480
| Tanimoto metric | 0.6241 |
|---|---|
| Cosine metric | 0.7702 |
| Dice metric | 0.7686 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+102 more
