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DocumentationIdentifier: MM245167
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM245167 |
| SMILES |
CCC(N)CC(N)C(=N)N
|
| InChIKey |
UMYKZKINZXRNEG-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
-0.62
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133628
Similarity: 0.8348
Similarity to MM133628
| Tanimoto metric | 0.8348 |
|---|---|
| Cosine metric | 0.9137 |
| Dice metric | 0.91 |
| MW: | 130.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245168
Similarity: 0.768
Similarity to MM245168
| Tanimoto metric | 0.768 |
|---|---|
| Cosine metric | 0.8695 |
| Dice metric | 0.8688 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245526
Similarity: 0.6599
Similarity to MM245526
| Tanimoto metric | 0.6599 |
|---|---|
| Cosine metric | 0.7964 |
| Dice metric | 0.7951 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+204 more
