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DocumentationIdentifier: MM245260
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM245260 |
| SMILES |
C=C(F)C(C)OC(C)CN
|
| InChIKey |
VMBNSWASKDBMPG-UHFFFAOYSA-N
|
| MW [Da] |
147.19
Automatically obtained from RDkit software. |
| LogP |
1.22
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM162192
Similarity: 0.8142
Similarity to MM162192
| Tanimoto metric | 0.8142 |
|---|---|
| Cosine metric | 0.9023 |
| Dice metric | 0.8976 |
| MW: | 133.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM144384
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| Tanimoto metric | 0.7168 |
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| Cosine metric | 0.8466 |
| Dice metric | 0.8351 |
| MW: | 133.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM108216
Similarity: 0.646
Similarity to MM108216
| Tanimoto metric | 0.646 |
|---|---|
| Cosine metric | 0.8038 |
| Dice metric | 0.7849 |
| MW: | 118.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+216 more
