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DocumentationIdentifier: MM364234
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM364234 |
| SMILES |
C=C(C=CCNC=O)CN
|
| InChIKey |
YLYWIGGSCQCJNE-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
-0.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM81232
Similarity: 0.8148
Similarity to MM81232
| Tanimoto metric | 0.8148 |
|---|---|
| Cosine metric | 0.9027 |
| Dice metric | 0.898 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM281747
Similarity: 0.7253
Similarity to MM281747
| Tanimoto metric | 0.7253 |
|---|---|
| Cosine metric | 0.8412 |
| Dice metric | 0.8408 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM364232
Similarity: 0.6804
Similarity to MM364232
| Tanimoto metric | 0.6804 |
|---|---|
| Cosine metric | 0.8098 |
| Dice metric | 0.8098 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+299 more
