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DocumentationIdentifier: MM239402
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM239402 |
| SMILES |
CC(N)(CO)CCNC=O
|
| InChIKey |
LFVAWRDIUVBFOO-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
MM227831
Similarity: 0.7281
Similarity to MM227831
| Tanimoto metric | 0.7281 |
|---|---|
| Cosine metric | 0.8429 |
| Dice metric | 0.8426 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM307727
Similarity: 0.713
Similarity to MM307727
| Tanimoto metric | 0.713 |
|---|---|
| Cosine metric | 0.8328 |
| Dice metric | 0.8325 |
| MW: | 148.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM165701
Similarity: 0.703
Similarity to MM165701
| Tanimoto metric | 0.703 |
|---|---|
| Cosine metric | 0.8384 |
| Dice metric | 0.8256 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+280 more
