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DocumentationIdentifier: MM133628
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM133628 |
| SMILES |
CC(N)CC(N)C(=N)N
|
| InChIKey |
BILQQKDDKFBJIU-UHFFFAOYSA-N
|
| MW [Da] |
130.2
Automatically obtained from RDkit software. |
| LogP |
-1.01
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM245168
Similarity: 0.9057
Similarity to MM245168
| Tanimoto metric | 0.9057 |
|---|---|
| Cosine metric | 0.9517 |
| Dice metric | 0.9505 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245167
Similarity: 0.8348
Similarity to MM245167
| Tanimoto metric | 0.8348 |
|---|---|
| Cosine metric | 0.9137 |
| Dice metric | 0.91 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245526
Similarity: 0.7442
Similarity to MM245526
| Tanimoto metric | 0.7442 |
|---|---|
| Cosine metric | 0.8627 |
| Dice metric | 0.8533 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+364 more
