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DocumentationIdentifier: MM295171
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM295171 |
| SMILES |
CC(C(N)=O)N1CC1
|
| InChIKey |
JARUVLODPRKCKG-UHFFFAOYSA-N
|
| MW [Da] |
114.15
Automatically obtained from RDkit software. |
| LogP |
-0.82
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM285008
Similarity: 0.763
Similarity to MM285008
| Tanimoto metric | 0.763 |
|---|---|
| Cosine metric | 0.8735 |
| Dice metric | 0.8655 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM299857
Similarity: 0.6959
Similarity to MM299857
| Tanimoto metric | 0.6959 |
|---|---|
| Cosine metric | 0.8342 |
| Dice metric | 0.8207 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM304401
Similarity: 0.6059
Similarity to MM304401
| Tanimoto metric | 0.6059 |
|---|---|
| Cosine metric | 0.7784 |
| Dice metric | 0.7546 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+7 more
