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DocumentationIdentifier: MM350189
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM350189 |
| SMILES |
CCCNC(=N)C(C)NC
|
| InChIKey |
AOIFMTOBPXLKDN-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
0.57
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM350191
Similarity: 0.8065
Similarity to MM350191
| Tanimoto metric | 0.8065 |
|---|---|
| Cosine metric | 0.8929 |
| Dice metric | 0.8929 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350471
Similarity: 0.708
Similarity to MM350471
| Tanimoto metric | 0.708 |
|---|---|
| Cosine metric | 0.8298 |
| Dice metric | 0.8291 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350473
Similarity: 0.708
Similarity to MM350473
| Tanimoto metric | 0.708 |
|---|---|
| Cosine metric | 0.8298 |
| Dice metric | 0.8291 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+430 more
