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DocumentationIdentifier: MM236539
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM236539 |
| SMILES |
CN(C)CC(N)CNC=N
|
| InChIKey |
UDWBMPKJXLDTGM-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
-0.93
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141712
Similarity: 0.7738
Similarity to MM141712
| Tanimoto metric | 0.7738 |
|---|---|
| Cosine metric | 0.8727 |
| Dice metric | 0.8725 |
| MW: | 130.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM135095
Similarity: 0.726
Similarity to MM135095
| Tanimoto metric | 0.726 |
|---|---|
| Cosine metric | 0.8521 |
| Dice metric | 0.8413 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM104218
Similarity: 0.5976
Similarity to MM104218
| Tanimoto metric | 0.5976 |
|---|---|
| Cosine metric | 0.753 |
| Dice metric | 0.7481 |
| MW: | 115.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+239 more
