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DocumentationIdentifier: MM363160
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363160 |
| SMILES |
CCC(N)CCCOC=O
|
| InChIKey |
UERAEEVNKMIURT-UHFFFAOYSA-N
|
| MW [Da] |
145.2
Automatically obtained from RDkit software. |
| LogP |
0.68
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165497
Similarity: 0.7895
Similarity to MM165497
| Tanimoto metric | 0.7895 |
|---|---|
| Cosine metric | 0.8885 |
| Dice metric | 0.8824 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291251
Similarity: 0.7363
Similarity to MM291251
| Tanimoto metric | 0.7363 |
|---|---|
| Cosine metric | 0.8487 |
| Dice metric | 0.8481 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291100
Similarity: 0.7317
Similarity to MM291100
| Tanimoto metric | 0.7317 |
|---|---|
| Cosine metric | 0.8472 |
| Dice metric | 0.8451 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+484 more
