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DocumentationIdentifier: MM268336
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM268336 |
| SMILES |
CN(C)CC(O)C(N)CN
|
| InChIKey |
ITGWAHJAOIUWCX-UHFFFAOYSA-N
|
| MW [Da] |
147.22
Automatically obtained from RDkit software. |
| LogP |
-1.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171820
Similarity: 0.8125
Similarity to MM171820
| Tanimoto metric | 0.8125 |
|---|---|
| Cosine metric | 0.9014 |
| Dice metric | 0.8966 |
| MW: | 133.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM133520
Similarity: 0.7679
Similarity to MM133520
| Tanimoto metric | 0.7679 |
|---|---|
| Cosine metric | 0.8763 |
| Dice metric | 0.8687 |
| MW: | 132.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268333
Similarity: 0.6741
Similarity to MM268333
| Tanimoto metric | 0.6741 |
|---|---|
| Cosine metric | 0.8053 |
| Dice metric | 0.8053 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+336 more
