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DocumentationIdentifier: MM348202
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM348202 |
| SMILES |
CCC(N)C(O)C(N)CO
|
| InChIKey |
WNFOEQXOEXLGQN-UHFFFAOYSA-N
|
| MW [Da] |
148.21
Automatically obtained from RDkit software. |
| LogP |
-1.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM159941
Similarity: 0.7479
Similarity to MM159941
| Tanimoto metric | 0.7479 |
|---|---|
| Cosine metric | 0.8648 |
| Dice metric | 0.8558 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM159939
Similarity: 0.7227
Similarity to MM159939
| Tanimoto metric | 0.7227 |
|---|---|
| Cosine metric | 0.8501 |
| Dice metric | 0.839 |
| MW: | 132.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348210
Similarity: 0.712
Similarity to MM348210
| Tanimoto metric | 0.712 |
|---|---|
| Cosine metric | 0.8371 |
| Dice metric | 0.8318 |
| MW: | 150.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -3.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+248 more
