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DocumentationIdentifier: MM304401
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM304401 |
| SMILES |
CC(C(N)=O)N1C(C)C1C
|
| InChIKey |
SBVDWZIXPUQJDC-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
-0.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM299857
Similarity: 0.8706
Similarity to MM299857
| Tanimoto metric | 0.8706 |
|---|---|
| Cosine metric | 0.9331 |
| Dice metric | 0.9308 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM302925
Similarity: 0.7235
Similarity to MM302925
| Tanimoto metric | 0.7235 |
|---|---|
| Cosine metric | 0.8506 |
| Dice metric | 0.8396 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM295171
Similarity: 0.6059
Similarity to MM295171
| Tanimoto metric | 0.6059 |
|---|---|
| Cosine metric | 0.7784 |
| Dice metric | 0.7546 |
| MW: | 114.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+5 more
