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DocumentationIdentifier: MM383040
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM383040 |
| SMILES |
CC(F)C(C=O)NCC=O
|
| InChIKey |
RQKUNUOCAXIHGM-UHFFFAOYSA-N
|
| MW [Da] |
147.15
Automatically obtained from RDkit software. |
| LogP |
-0.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM373198
Similarity: 0.5882
Similarity to MM373198
| Tanimoto metric | 0.5882 |
|---|---|
| Cosine metric | 0.7407 |
| Dice metric | 0.7407 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM39431
Similarity: 0.5427
Similarity to MM39431
| Tanimoto metric | 0.5427 |
|---|---|
| Cosine metric | 0.7042 |
| Dice metric | 0.7036 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM323604
Similarity: 0.5283
Similarity to MM323604
| Tanimoto metric | 0.5283 |
|---|---|
| Cosine metric | 0.6914 |
| Dice metric | 0.6914 |
| MW: | 130.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+107 more
