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DocumentationIdentifier: MM45225
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM45225 |
| SMILES |
CN(C)CC(F)F
|
| InChIKey |
IOFLCUURUWGMDN-UHFFFAOYSA-N
|
| MW [Da] |
109.12
Automatically obtained from RDkit software. |
| LogP |
0.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM35140
Similarity: 0.7674
Similarity to MM35140
| Tanimoto metric | 0.7674 |
|---|---|
| Cosine metric | 0.876 |
| Dice metric | 0.8684 |
| MW: | 127.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM104183
Similarity: 0.7333
Similarity to MM104183
| Tanimoto metric | 0.7333 |
|---|---|
| Cosine metric | 0.8563 |
| Dice metric | 0.8462 |
| MW: | 123.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM97075
Similarity: 0.6341
Similarity to MM97075
| Tanimoto metric | 0.6341 |
|---|---|
| Cosine metric | 0.7762 |
| Dice metric | 0.7761 |
| MW: | 113.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+186 more
