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DocumentationIdentifier: MM233219
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM233219 |
| SMILES |
C=CC(C)C(C)(F)CCO
|
| InChIKey |
CIICKEWFDJLPHT-UHFFFAOYSA-N
|
| MW [Da] |
146.21
Automatically obtained from RDkit software. |
| LogP |
1.92
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM132363
Similarity: 0.7203
Similarity to MM132363
| Tanimoto metric | 0.7203 |
|---|---|
| Cosine metric | 0.8487 |
| Dice metric | 0.8374 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243015
Similarity: 0.688
Similarity to MM243015
| Tanimoto metric | 0.688 |
|---|---|
| Cosine metric | 0.8209 |
| Dice metric | 0.8152 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132571
Similarity: 0.6441
Similarity to MM132571
| Tanimoto metric | 0.6441 |
|---|---|
| Cosine metric | 0.8025 |
| Dice metric | 0.7835 |
| MW: | 134.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+389 more
