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DocumentationIdentifier: MM272426
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272426 |
| SMILES |
C=CC(CNC)CC(=N)N
|
| InChIKey |
HTJYAPQXLZLXMB-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.33
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149990
Similarity: 0.7632
Similarity to MM149990
| Tanimoto metric | 0.7632 |
|---|---|
| Cosine metric | 0.8736 |
| Dice metric | 0.8657 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM393266
Similarity: 0.6454
Similarity to MM393266
| Tanimoto metric | 0.6454 |
|---|---|
| Cosine metric | 0.7846 |
| Dice metric | 0.7845 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM272742
Similarity: 0.6268
Similarity to MM272742
| Tanimoto metric | 0.6268 |
|---|---|
| Cosine metric | 0.7706 |
| Dice metric | 0.7706 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+262 more
