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DocumentationIdentifier: MM244604
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244604 |
| SMILES |
CC(CF)CC(N)C(C)C
|
| InChIKey |
QIUNOCMGPMCEQU-UHFFFAOYSA-N
|
| MW [Da] |
147.24
Automatically obtained from RDkit software. |
| LogP |
1.97
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141500
Similarity: 0.8659
Similarity to MM141500
| Tanimoto metric | 0.8659 |
|---|---|
| Cosine metric | 0.9305 |
| Dice metric | 0.9281 |
| MW: | 133.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261145
Similarity: 0.8202
Similarity to MM261145
| Tanimoto metric | 0.8202 |
|---|---|
| Cosine metric | 0.9013 |
| Dice metric | 0.9012 |
| MW: | 151.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268254
Similarity: 0.8065
Similarity to MM268254
| Tanimoto metric | 0.8065 |
|---|---|
| Cosine metric | 0.8931 |
| Dice metric | 0.8929 |
| MW: | 147.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+569 more
