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DocumentationIdentifier: MM159941
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM159941 |
| SMILES |
CC(N)C(O)C(N)CO
|
| InChIKey |
FLHZVJQNWBPYHF-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
-1.99
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM348210
Similarity: 0.9368
Similarity to MM348210
| Tanimoto metric | 0.9368 |
|---|---|
| Cosine metric | 0.9679 |
| Dice metric | 0.9674 |
| MW: | 150.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -3.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348202
Similarity: 0.7479
Similarity to MM348202
| Tanimoto metric | 0.7479 |
|---|---|
| Cosine metric | 0.8648 |
| Dice metric | 0.8558 |
| MW: | 148.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM171783
Similarity: 0.7474
Similarity to MM171783
| Tanimoto metric | 0.7474 |
|---|---|
| Cosine metric | 0.8577 |
| Dice metric | 0.8554 |
| MW: | 135.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+300 more
