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DocumentationIdentifier: MM319477
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM319477 |
| SMILES |
C=CC(=O)NCC(=O)NC
|
| InChIKey |
BJSLYVAQHMBTCU-UHFFFAOYSA-N
|
| MW [Da] |
142.16
Automatically obtained from RDkit software. |
| LogP |
-0.97
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM145142
Similarity: 0.8317
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| Tanimoto metric | 0.8317 |
|---|---|
| Cosine metric | 0.912 |
| Dice metric | 0.9081 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM319811
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| Tanimoto metric | 0.5891 |
|---|---|
| Cosine metric | 0.7415 |
| Dice metric | 0.7415 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM318845
Similarity: 0.5781
Similarity to MM318845
| Tanimoto metric | 0.5781 |
|---|---|
| Cosine metric | 0.7327 |
| Dice metric | 0.7327 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+23 more
