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DocumentationIdentifier: MM292810
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292810 |
| SMILES |
CCNC(=O)C(O)CCN
|
| InChIKey |
XJSXLRSAYDVQML-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
-1.17
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM50244
Similarity: 0.8385
Similarity to MM50244
| Tanimoto metric | 0.8385 |
|---|---|
| Cosine metric | 0.9157 |
| Dice metric | 0.9121 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172380
Similarity: 0.8
Similarity to MM172380
| Tanimoto metric | 0.8 |
|---|---|
| Cosine metric | 0.8944 |
| Dice metric | 0.8889 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM350678
Similarity: 0.7097
Similarity to MM350678
| Tanimoto metric | 0.7097 |
|---|---|
| Cosine metric | 0.8303 |
| Dice metric | 0.8302 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+310 more
