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DocumentationIdentifier: MM239328
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM239328 |
| SMILES |
CCCOCC(F)(F)CO
|
| InChIKey |
OGCLWEQWDPVUOP-UHFFFAOYSA-N
|
| MW [Da] |
154.16
Automatically obtained from RDkit software. |
| LogP |
1.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM232313
Similarity: 0.85
Similarity to MM232313
| Tanimoto metric | 0.85 |
|---|---|
| Cosine metric | 0.9203 |
| Dice metric | 0.9189 |
| MW: | 154.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM131492
Similarity: 0.7949
Similarity to MM131492
| Tanimoto metric | 0.7949 |
|---|---|
| Cosine metric | 0.8916 |
| Dice metric | 0.8857 |
| MW: | 138.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM227803
Similarity: 0.734
Similarity to MM227803
| Tanimoto metric | 0.734 |
|---|---|
| Cosine metric | 0.8474 |
| Dice metric | 0.8466 |
| MW: | 154.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+432 more
