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DocumentationIdentifier: MM302120
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM302120 |
| SMILES |
COCCNC(=N)C(C)O
|
| InChIKey |
CDNBPBMBTBQDNJ-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
-0.42
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162408
Similarity: 0.8519
Similarity to MM162408
| Tanimoto metric | 0.8519 |
|---|---|
| Cosine metric | 0.923 |
| Dice metric | 0.92 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350197
Similarity: 0.7923
Similarity to MM350197
| Tanimoto metric | 0.7923 |
|---|---|
| Cosine metric | 0.8865 |
| Dice metric | 0.8841 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM254921
Similarity: 0.7541
Similarity to MM254921
| Tanimoto metric | 0.7541 |
|---|---|
| Cosine metric | 0.8599 |
| Dice metric | 0.8598 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+551 more
