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DocumentationIdentifier: MM440503
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM440503 |
| SMILES |
CN1CC1CC(C=O)C=O
|
| InChIKey |
ILYJMPACSSAPMJ-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
-0.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM373748
Similarity: 0.9242
Similarity to MM373748
| Tanimoto metric | 0.9242 |
|---|---|
| Cosine metric | 0.9614 |
| Dice metric | 0.9606 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM277487
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| Tanimoto metric | 0.7922 |
|---|---|
| Cosine metric | 0.8849 |
| Dice metric | 0.8841 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM379813
Similarity: 0.7485
Similarity to MM379813
| Tanimoto metric | 0.7485 |
|---|---|
| Cosine metric | 0.8585 |
| Dice metric | 0.8561 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+35 more
