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DocumentationIdentifier: MM261393
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM261393 |
| SMILES |
CCC(N)CC(C)NC=O
|
| InChIKey |
XSBZACDUWKVYMJ-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.25
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM272011
Similarity: 0.85
Similarity to MM272011
| Tanimoto metric | 0.85 |
|---|---|
| Cosine metric | 0.9189 |
| Dice metric | 0.9189 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM92500
Similarity: 0.7374
Similarity to MM92500
| Tanimoto metric | 0.7374 |
|---|---|
| Cosine metric | 0.8517 |
| Dice metric | 0.8488 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM72481
Similarity: 0.7212
Similarity to MM72481
| Tanimoto metric | 0.7212 |
|---|---|
| Cosine metric | 0.8386 |
| Dice metric | 0.838 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+374 more
