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DocumentationIdentifier: MM263054
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM263054 |
| SMILES |
CNC(=N)CC(=O)COC
|
| InChIKey |
OTLFVGZPRILBFE-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
-0.21
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM333200
Similarity: 0.6446
Similarity to MM333200
| Tanimoto metric | 0.6446 |
|---|---|
| Cosine metric | 0.7845 |
| Dice metric | 0.7839 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM104539
Similarity: 0.5954
Similarity to MM104539
| Tanimoto metric | 0.5954 |
|---|---|
| Cosine metric | 0.7716 |
| Dice metric | 0.7464 |
| MW: | 116.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297508
Similarity: 0.5313
Similarity to MM297508
| Tanimoto metric | 0.5313 |
|---|---|
| Cosine metric | 0.698 |
| Dice metric | 0.6939 |
| MW: | 146.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+80 more
