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DocumentationIdentifier: MM245208
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM245208 |
| SMILES |
CC(=O)C(F)CC(O)CF
|
| InChIKey |
NSIMVNXOCSMKHI-UHFFFAOYSA-N
|
| MW [Da] |
152.14
Automatically obtained from RDkit software. |
| LogP |
0.63
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM245207
Similarity: 0.7133
Similarity to MM245207
| Tanimoto metric | 0.7133 |
|---|---|
| Cosine metric | 0.8328 |
| Dice metric | 0.8327 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268663
Similarity: 0.6667
Similarity to MM268663
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8003 |
| Dice metric | 0.8 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268664
Similarity: 0.6415
Similarity to MM268664
| Tanimoto metric | 0.6415 |
|---|---|
| Cosine metric | 0.7816 |
| Dice metric | 0.7816 |
| MW: | 150.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+176 more
