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DocumentationIdentifier: MM348353
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM348353 |
| SMILES |
C=CC(N)C(O)C(N)CC
|
| InChIKey |
OWKMXQQXFTVGAN-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
-0.4
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM160024
Similarity: 0.7519
Similarity to MM160024
| Tanimoto metric | 0.7519 |
|---|---|
| Cosine metric | 0.8671 |
| Dice metric | 0.8584 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348503
Similarity: 0.6713
Similarity to MM348503
| Tanimoto metric | 0.6713 |
|---|---|
| Cosine metric | 0.8085 |
| Dice metric | 0.8033 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM77056
Similarity: 0.6692
Similarity to MM77056
| Tanimoto metric | 0.6692 |
|---|---|
| Cosine metric | 0.818 |
| Dice metric | 0.8018 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+320 more
