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DocumentationIdentifier: MM460603
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM460603 |
| SMILES |
CCN1CC1C(=O)CO
|
| InChIKey |
DNIFBJVOFVKMRV-UHFFFAOYSA-N
|
| MW [Da] |
129.16
Automatically obtained from RDkit software. |
| LogP |
-0.75
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM460555
Similarity: 0.7654
Similarity to MM460555
| Tanimoto metric | 0.7654 |
|---|---|
| Cosine metric | 0.8749 |
| Dice metric | 0.8671 |
| MW: | 115.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM403078
Similarity: 0.7039
Similarity to MM403078
| Tanimoto metric | 0.7039 |
|---|---|
| Cosine metric | 0.839 |
| Dice metric | 0.8262 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM460610
Similarity: 0.6766
Similarity to MM460610
| Tanimoto metric | 0.6766 |
|---|---|
| Cosine metric | 0.8105 |
| Dice metric | 0.8071 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+85 more
