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DocumentationIdentifier: MM288601
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM288601 |
| SMILES |
CC(=O)NC=CCOC=O
|
| InChIKey |
XWUOOFMWGABHBZ-UHFFFAOYSA-N
|
| MW [Da] |
143.14
Automatically obtained from RDkit software. |
| LogP |
-0.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM373241
Similarity: 0.7115
Similarity to MM373241
| Tanimoto metric | 0.7115 |
|---|---|
| Cosine metric | 0.8319 |
| Dice metric | 0.8315 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM64296
Similarity: 0.6218
Similarity to MM64296
| Tanimoto metric | 0.6218 |
|---|---|
| Cosine metric | 0.7714 |
| Dice metric | 0.7668 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM168512
Similarity: 0.5865
Similarity to MM168512
| Tanimoto metric | 0.5865 |
|---|---|
| Cosine metric | 0.7401 |
| Dice metric | 0.7394 |
| MW: | 131.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+422 more
