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DocumentationIdentifier: MM345832
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM345832 |
| SMILES |
OCC(CO)OC=C(F)F
|
| InChIKey |
GCDRBRJVJLBLEU-UHFFFAOYSA-N
|
| MW [Da] |
154.11
Automatically obtained from RDkit software. |
| LogP |
0.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM146311
Similarity: 0.8961
Similarity to MM146311
| Tanimoto metric | 0.8961 |
|---|---|
| Cosine metric | 0.9466 |
| Dice metric | 0.9452 |
| MW: | 138.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM199468
Similarity: 0.8182
Similarity to MM199468
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9045 |
| Dice metric | 0.9 |
| MW: | 136.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM228765
Similarity: 0.7263
Similarity to MM228765
| Tanimoto metric | 0.7263 |
|---|---|
| Cosine metric | 0.843 |
| Dice metric | 0.8415 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+378 more
