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DocumentationIdentifier: MM334996
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM334996 |
| SMILES |
C=CC(=CF)OC(C)=CF
|
| InChIKey |
FRECDFVWMALOCF-UHFFFAOYSA-N
|
| MW [Da] |
146.14
Automatically obtained from RDkit software. |
| LogP |
2.83
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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MM334470
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| Tanimoto metric | 0.93 |
|---|---|
| Cosine metric | 0.9637 |
| Dice metric | 0.9637 |
| MW: | 140.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM150556
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| Tanimoto metric | 0.9072 |
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| Cosine metric | 0.9525 |
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| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.53 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM143197
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| Tanimoto metric | 0.8763 |
|---|---|
| Cosine metric | 0.9361 |
| Dice metric | 0.9341 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+391 more
