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DocumentationIdentifier: MM290610
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM290610 |
| SMILES |
O=CC=CC=CC=C(F)F
|
| InChIKey |
QLMXAIHBCCTPIH-UHFFFAOYSA-N
|
| MW [Da] |
144.12
Automatically obtained from RDkit software. |
| LogP |
2.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM215722
Similarity: 0.807
Similarity to MM215722
| Tanimoto metric | 0.807 |
|---|---|
| Cosine metric | 0.8983 |
| Dice metric | 0.8932 |
| MW: | 126.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM290609
Similarity: 0.7288
Similarity to MM290609
| Tanimoto metric | 0.7288 |
|---|---|
| Cosine metric | 0.849 |
| Dice metric | 0.8431 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM106642
Similarity: 0.6721
Similarity to MM106642
| Tanimoto metric | 0.6721 |
|---|---|
| Cosine metric | 0.8095 |
| Dice metric | 0.8039 |
| MW: | 118.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+317 more
