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DocumentationIdentifier: MM107204
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM107204 |
| SMILES |
N#CCC(F)CCF
|
| InChIKey |
DMPRLSMAEMEASR-UHFFFAOYSA-N
|
| MW [Da] |
119.11
Automatically obtained from RDkit software. |
| LogP |
1.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM135126
Similarity: 0.7463
Similarity to MM135126
| Tanimoto metric | 0.7463 |
|---|---|
| Cosine metric | 0.8639 |
| Dice metric | 0.8547 |
| MW: | 133.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM97909
Similarity: 0.72
Similarity to MM97909
| Tanimoto metric | 0.72 |
|---|---|
| Cosine metric | 0.8485 |
| Dice metric | 0.8372 |
| MW: | 101.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM36158
Similarity: 0.6393
Similarity to MM36158
| Tanimoto metric | 0.6393 |
|---|---|
| Cosine metric | 0.78 |
| Dice metric | 0.78 |
| MW: | 119.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+366 more
