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DocumentationIdentifier: MM243208
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM243208 |
| SMILES |
CC(C=O)(CC=O)NC=O
|
| InChIKey |
BNLUWHZHYAQPNG-UHFFFAOYSA-N
|
| MW [Da] |
143.14
Automatically obtained from RDkit software. |
| LogP |
-0.72
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM42267
Similarity: 0.7647
Similarity to MM42267
| Tanimoto metric | 0.7647 |
|---|---|
| Cosine metric | 0.8745 |
| Dice metric | 0.8667 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243743
Similarity: 0.6458
Similarity to MM243743
| Tanimoto metric | 0.6458 |
|---|---|
| Cosine metric | 0.7848 |
| Dice metric | 0.7848 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243165
Similarity: 0.5987
Similarity to MM243165
| Tanimoto metric | 0.5987 |
|---|---|
| Cosine metric | 0.7491 |
| Dice metric | 0.749 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+32 more
