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DocumentationIdentifier: MM184855
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM184855 |
| SMILES |
COC(=O)CN1CC1C
|
| InChIKey |
MTJCAKYFSJWRJF-UHFFFAOYSA-N
|
| MW [Da] |
129.16
Automatically obtained from RDkit software. |
| LogP |
-0.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM309423
Similarity: 0.8782
Similarity to MM309423
| Tanimoto metric | 0.8782 |
|---|---|
| Cosine metric | 0.9371 |
| Dice metric | 0.9352 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM404301
Similarity: 0.7737
Similarity to MM404301
| Tanimoto metric | 0.7737 |
|---|---|
| Cosine metric | 0.8796 |
| Dice metric | 0.8724 |
| MW: | 115.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM400661
Similarity: 0.6584
Similarity to MM400661
| Tanimoto metric | 0.6584 |
|---|---|
| Cosine metric | 0.7943 |
| Dice metric | 0.794 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+7 more
