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DocumentationIdentifier: MM275341
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM275341 |
| SMILES |
CCC(N=C(C)N)C(C)=O
|
| InChIKey |
PNCUIQAMTYTRAR-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133737
Similarity: 0.8284
Similarity to MM133737
| Tanimoto metric | 0.8284 |
|---|---|
| Cosine metric | 0.9101 |
| Dice metric | 0.9061 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM85313
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Similarity to MM85313
| Tanimoto metric | 0.7388 |
|---|---|
| Cosine metric | 0.8595 |
| Dice metric | 0.8498 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM60167
Similarity: 0.7015
Similarity to MM60167
| Tanimoto metric | 0.7015 |
|---|---|
| Cosine metric | 0.8376 |
| Dice metric | 0.8246 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+50 more
