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DocumentationIdentifier: MM221090
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM221090 |
| SMILES |
CC(F)(F)CC(O)CCO
|
| InChIKey |
LWNJTSVYWQJKBB-UHFFFAOYSA-N
|
| MW [Da] |
154.16
Automatically obtained from RDkit software. |
| LogP |
0.78
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM129999
Similarity: 0.8173
Similarity to MM129999
| Tanimoto metric | 0.8173 |
|---|---|
| Cosine metric | 0.9041 |
| Dice metric | 0.8995 |
| MW: | 138.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM135062
Similarity: 0.7308
Similarity to MM135062
| Tanimoto metric | 0.7308 |
|---|---|
| Cosine metric | 0.8549 |
| Dice metric | 0.8444 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM221125
Similarity: 0.6565
Similarity to MM221125
| Tanimoto metric | 0.6565 |
|---|---|
| Cosine metric | 0.7933 |
| Dice metric | 0.7926 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+398 more
