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DocumentationIdentifier: MM352209
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM352209 |
| SMILES |
CC(CO)CC(=CF)CF
|
| InChIKey |
UISQXAVXQXBQLO-UHFFFAOYSA-N
|
| MW [Da] |
150.17
Automatically obtained from RDkit software. |
| LogP |
1.83
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM322126
Similarity: 0.7217
Similarity to MM322126
| Tanimoto metric | 0.7217 |
|---|---|
| Cosine metric | 0.8496 |
| Dice metric | 0.8384 |
| MW: | 136.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM330866
Similarity: 0.6434
Similarity to MM330866
| Tanimoto metric | 0.6434 |
|---|---|
| Cosine metric | 0.7832 |
| Dice metric | 0.783 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM378711
Similarity: 0.6119
Similarity to MM378711
| Tanimoto metric | 0.6119 |
|---|---|
| Cosine metric | 0.7609 |
| Dice metric | 0.7593 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+347 more
