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DocumentationIdentifier: MM275022
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM275022 |
| SMILES |
C=C(C)CC(CF)C(C)O
|
| InChIKey |
YTLNQPNTEAWLCT-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
MM179637
Similarity: 0.6765
Similarity to MM179637
| Tanimoto metric | 0.6765 |
|---|---|
| Cosine metric | 0.8225 |
| Dice metric | 0.807 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM391061
Similarity: 0.6618
Similarity to MM391061
| Tanimoto metric | 0.6618 |
|---|---|
| Cosine metric | 0.8135 |
| Dice metric | 0.7965 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM275027
Similarity: 0.619
Similarity to MM275027
| Tanimoto metric | 0.619 |
|---|---|
| Cosine metric | 0.7647 |
| Dice metric | 0.7647 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+376 more
