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DocumentationIdentifier: MM162426
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM162426 |
| SMILES |
C=C(OCCN)C(C)N
|
| InChIKey |
ZUDKCLLBAWICBI-UHFFFAOYSA-N
|
| MW [Da] |
130.19
Automatically obtained from RDkit software. |
| LogP |
-0.18
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM108369
Similarity: 0.8588
Similarity to MM108369
| Tanimoto metric | 0.8588 |
|---|---|
| Cosine metric | 0.9267 |
| Dice metric | 0.9241 |
| MW: | 115.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM162425
Similarity: 0.8298
Similarity to MM162425
| Tanimoto metric | 0.8298 |
|---|---|
| Cosine metric | 0.907 |
| Dice metric | 0.907 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM133915
Similarity: 0.713
Similarity to MM133915
| Tanimoto metric | 0.713 |
|---|---|
| Cosine metric | 0.8352 |
| Dice metric | 0.8324 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+690 more
