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DocumentationIdentifier: MM87413
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM87413 |
| SMILES |
CCOCC(CCO)OC
|
| InChIKey |
MKUALEVAQMPPPO-UHFFFAOYSA-N
|
| MW [Da] |
148.2
Automatically obtained from RDkit software. |
| LogP |
0.42
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM198561
Similarity: 0.7791
Similarity to MM198561
| Tanimoto metric | 0.7791 |
|---|---|
| Cosine metric | 0.8826 |
| Dice metric | 0.8758 |
| MW: | 132.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM87394
Similarity: 0.7419
Similarity to MM87394
| Tanimoto metric | 0.7419 |
|---|---|
| Cosine metric | 0.8535 |
| Dice metric | 0.8519 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402171
Similarity: 0.734
Similarity to MM402171
| Tanimoto metric | 0.734 |
|---|---|
| Cosine metric | 0.8479 |
| Dice metric | 0.8466 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+627 more
