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DocumentationIdentifier: MM61295
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM61295 |
| SMILES |
CCCNCC(F)CNC
|
| InChIKey |
LUWANJIVSBAKPI-UHFFFAOYSA-N
|
| MW [Da] |
148.23
Automatically obtained from RDkit software. |
| LogP |
0.54
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM61276
Similarity: 0.9063
Similarity to MM61276
| Tanimoto metric | 0.9063 |
|---|---|
| Cosine metric | 0.952 |
| Dice metric | 0.9508 |
| MW: | 134.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM60095
Similarity: 0.875
Similarity to MM60095
| Tanimoto metric | 0.875 |
|---|---|
| Cosine metric | 0.9354 |
| Dice metric | 0.9333 |
| MW: | 134.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM286923
Similarity: 0.8485
Similarity to MM286923
| Tanimoto metric | 0.8485 |
|---|---|
| Cosine metric | 0.9191 |
| Dice metric | 0.918 |
| MW: | 148.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+381 more
