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DocumentationIdentifier: MM196774
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM196774 |
| SMILES |
CCC(CF)C(C)CN
|
| InChIKey |
NVODEBZUDWMGQE-UHFFFAOYSA-N
|
| MW [Da] |
133.21
Automatically obtained from RDkit software. |
| LogP |
1.58
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM387795
Similarity: 0.8734
Similarity to MM387795
| Tanimoto metric | 0.8734 |
|---|---|
| Cosine metric | 0.9346 |
| Dice metric | 0.9324 |
| MW: | 147.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM86060
Similarity: 0.8219
Similarity to MM86060
| Tanimoto metric | 0.8219 |
|---|---|
| Cosine metric | 0.9029 |
| Dice metric | 0.9023 |
| MW: | 133.21 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM196777
Similarity: 0.7975
Similarity to MM196777
| Tanimoto metric | 0.7975 |
|---|---|
| Cosine metric | 0.8877 |
| Dice metric | 0.8873 |
| MW: | 133.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+499 more
