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DocumentationIdentifier: MM292844
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292844 |
| SMILES |
CCNC(=N)C(C)OCC
|
| InChIKey |
AQQQGQPJWNQOSZ-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM172421
Similarity: 0.8168
Similarity to MM172421
| Tanimoto metric | 0.8168 |
|---|---|
| Cosine metric | 0.9038 |
| Dice metric | 0.8992 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM349005
Similarity: 0.7431
Similarity to MM349005
| Tanimoto metric | 0.7431 |
|---|---|
| Cosine metric | 0.8534 |
| Dice metric | 0.8526 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350197
Similarity: 0.7415
Similarity to MM350197
| Tanimoto metric | 0.7415 |
|---|---|
| Cosine metric | 0.8518 |
| Dice metric | 0.8516 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+293 more
