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DocumentationIdentifier: MM334488
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM334488 |
| SMILES |
C=CC(=O)OC(C=O)=CC
|
| InChIKey |
KYBJGQAADPSEOB-UHFFFAOYSA-N
|
| MW [Da] |
140.14
Automatically obtained from RDkit software. |
| LogP |
0.82
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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MM143201
Similarity: 0.7388
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| Tanimoto metric | 0.7388 |
|---|---|
| Cosine metric | 0.8595 |
| Dice metric | 0.8498 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM142842
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| Cosine metric | 0.8552 |
| Dice metric | 0.8448 |
| MW: | 126.11 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
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| LogP: | 0.43 |
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Total active interactions
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MM264582
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Similarity to MM264582
| Tanimoto metric | 0.7114 |
|---|---|
| Cosine metric | 0.8325 |
| Dice metric | 0.8314 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+86 more
