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DocumentationIdentifier: MM362188
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM362188 |
| SMILES |
CCC(C)C(N)COC=O
|
| InChIKey |
HLTKHQKNIKMGQY-UHFFFAOYSA-N
|
| MW [Da] |
145.2
Automatically obtained from RDkit software. |
| LogP |
0.53
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162063
Similarity: 0.7596
Similarity to MM162063
| Tanimoto metric | 0.7596 |
|---|---|
| Cosine metric | 0.8716 |
| Dice metric | 0.8634 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236511
Similarity: 0.6897
Similarity to MM236511
| Tanimoto metric | 0.6897 |
|---|---|
| Cosine metric | 0.8179 |
| Dice metric | 0.8163 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM231294
Similarity: 0.6695
Similarity to MM231294
| Tanimoto metric | 0.6695 |
|---|---|
| Cosine metric | 0.8033 |
| Dice metric | 0.802 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+216 more
