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DocumentationIdentifier: MM460537
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM460537 |
| SMILES |
O=C(CO)C1CN1
|
| InChIKey |
YENYXHRPXDEDBT-UHFFFAOYSA-N
|
| MW [Da] |
101.11
Automatically obtained from RDkit software. |
| LogP |
-1.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM363087
Similarity: 0.7563
Similarity to MM363087
| Tanimoto metric | 0.7563 |
|---|---|
| Cosine metric | 0.8697 |
| Dice metric | 0.8612 |
| MW: | 115.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM460555
Similarity: 0.6569
Similarity to MM460555
| Tanimoto metric | 0.6569 |
|---|---|
| Cosine metric | 0.8105 |
| Dice metric | 0.793 |
| MW: | 115.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM189690
Similarity: 0.6522
Similarity to MM189690
| Tanimoto metric | 0.6522 |
|---|---|
| Cosine metric | 0.8076 |
| Dice metric | 0.7895 |
| MW: | 115.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+69 more
