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DocumentationIdentifier: MM419698
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM419698 |
| SMILES |
C=CC=COC(=CC)CO
|
| InChIKey |
VJHCNEVGVIULJE-UHFFFAOYSA-N
|
| MW [Da] |
140.18
Automatically obtained from RDkit software. |
| LogP |
1.6
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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MM200364
Similarity: 0.8427
Similarity to MM200364
| Tanimoto metric | 0.8427 |
|---|---|
| Cosine metric | 0.918 |
| Dice metric | 0.9146 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM168700
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| Cosine metric | 0.8741 |
| Dice metric | 0.8662 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM418857
Similarity: 0.7451
Similarity to MM418857
| Tanimoto metric | 0.7451 |
|---|---|
| Cosine metric | 0.8539 |
| Dice metric | 0.8539 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+467 more
