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DocumentationIdentifier: MM154170
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM154170 |
| SMILES |
C=CCCC=CC(=C)F
|
| InChIKey |
IDFPTMVYPKIFOK-UHFFFAOYSA-N
|
| MW [Da] |
126.17
Automatically obtained from RDkit software. |
| LogP |
2.99
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM106290
Similarity: 0.9123
Similarity to MM106290
| Tanimoto metric | 0.9123 |
|---|---|
| Cosine metric | 0.9551 |
| Dice metric | 0.9541 |
| MW: | 114.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM154119
Similarity: 0.8154
Similarity to MM154119
| Tanimoto metric | 0.8154 |
|---|---|
| Cosine metric | 0.8988 |
| Dice metric | 0.8983 |
| MW: | 132.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM154117
Similarity: 0.7324
Similarity to MM154117
| Tanimoto metric | 0.7324 |
|---|---|
| Cosine metric | 0.8478 |
| Dice metric | 0.8455 |
| MW: | 129.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+412 more
