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DocumentationIdentifier: MM361756
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM361756 |
| SMILES |
CCCCC(N)C(O)CN
|
| InChIKey |
ANHNHADOAOTGNS-UHFFFAOYSA-N
|
| MW [Da] |
146.23
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
MM171765
Similarity: 0.8571
Similarity to MM171765
| Tanimoto metric | 0.8571 |
|---|---|
| Cosine metric | 0.9258 |
| Dice metric | 0.9231 |
| MW: | 132.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM161932
Similarity: 0.7653
Similarity to MM161932
| Tanimoto metric | 0.7653 |
|---|---|
| Cosine metric | 0.8748 |
| Dice metric | 0.8671 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM300875
Similarity: 0.7404
Similarity to MM300875
| Tanimoto metric | 0.7404 |
|---|---|
| Cosine metric | 0.8538 |
| Dice metric | 0.8508 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+401 more
