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DocumentationIdentifier: MM301299
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM301299 |
| SMILES |
C=COCCN(C)C(C)C
|
| InChIKey |
XCMDXXZJBGHCOU-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
1.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165860
Similarity: 0.8026
Similarity to MM165860
| Tanimoto metric | 0.8026 |
|---|---|
| Cosine metric | 0.8959 |
| Dice metric | 0.8905 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402675
Similarity: 0.7625
Similarity to MM402675
| Tanimoto metric | 0.7625 |
|---|---|
| Cosine metric | 0.8679 |
| Dice metric | 0.8652 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM40867
Similarity: 0.7439
Similarity to MM40867
| Tanimoto metric | 0.7439 |
|---|---|
| Cosine metric | 0.8548 |
| Dice metric | 0.8531 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+444 more
