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DocumentationIdentifier: MM64714
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM64714 |
| SMILES |
C=C(CF)CC(O)CCO
|
| InChIKey |
VDLJEDPKACDSOC-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
0.65
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141934
Similarity: 0.8165
Similarity to MM141934
| Tanimoto metric | 0.8165 |
|---|---|
| Cosine metric | 0.9036 |
| Dice metric | 0.899 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262018
Similarity: 0.7355
Similarity to MM262018
| Tanimoto metric | 0.7355 |
|---|---|
| Cosine metric | 0.8482 |
| Dice metric | 0.8476 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261843
Similarity: 0.7355
Similarity to MM261843
| Tanimoto metric | 0.7355 |
|---|---|
| Cosine metric | 0.8482 |
| Dice metric | 0.8476 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+472 more
