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DocumentationIdentifier: MM328747
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM328747 |
| SMILES |
C=C(CN)OC(CN)CO
|
| InChIKey |
ZXIWBRNLOGODTC-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
-1.21
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM328749
Similarity: 0.7597
Similarity to MM328749
| Tanimoto metric | 0.7597 |
|---|---|
| Cosine metric | 0.8634 |
| Dice metric | 0.8634 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328751
Similarity: 0.6935
Similarity to MM328751
| Tanimoto metric | 0.6935 |
|---|---|
| Cosine metric | 0.8221 |
| Dice metric | 0.819 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328746
Similarity: 0.6835
Similarity to MM328746
| Tanimoto metric | 0.6835 |
|---|---|
| Cosine metric | 0.8122 |
| Dice metric | 0.812 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+314 more
