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DocumentationIdentifier: MM261473
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM261473 |
| SMILES |
C#CCC(F)CC(F)CC
|
| InChIKey |
DGSUBYOAQLBDRB-UHFFFAOYSA-N
|
| MW [Da] |
146.18
Automatically obtained from RDkit software. |
| LogP |
2.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156024
Similarity: 0.7838
Similarity to MM156024
| Tanimoto metric | 0.7838 |
|---|---|
| Cosine metric | 0.8853 |
| Dice metric | 0.8788 |
| MW: | 128.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261820
Similarity: 0.764
Similarity to MM261820
| Tanimoto metric | 0.764 |
|---|---|
| Cosine metric | 0.8677 |
| Dice metric | 0.8662 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291344
Similarity: 0.75
Similarity to MM291344
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8585 |
| Dice metric | 0.8571 |
| MW: | 146.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+607 more
