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DocumentationIdentifier: MM50244
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM50244 |
| SMILES |
CCNC(=O)C(O)CC
|
| InChIKey |
TYEUXSRAMCAJCV-UHFFFAOYSA-N
|
| MW [Da] |
131.18
Automatically obtained from RDkit software. |
| LogP |
-0.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM292810
Similarity: 0.8385
Similarity to MM292810
| Tanimoto metric | 0.8385 |
|---|---|
| Cosine metric | 0.9157 |
| Dice metric | 0.9121 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350678
Similarity: 0.8074
Similarity to MM350678
| Tanimoto metric | 0.8074 |
|---|---|
| Cosine metric | 0.8986 |
| Dice metric | 0.8934 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM111756
Similarity: 0.7798
Similarity to MM111756
| Tanimoto metric | 0.7798 |
|---|---|
| Cosine metric | 0.8831 |
| Dice metric | 0.8763 |
| MW: | 117.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+657 more
