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DocumentationIdentifier: MM259043
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM259043 |
| SMILES |
C=C(F)C=CCN(C)C=O
|
| InChIKey |
NBLMIDJGEMYCQG-UHFFFAOYSA-N
|
| MW [Da] |
143.16
Automatically obtained from RDkit software. |
| LogP |
1.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM168366
Similarity: 0.6966
Similarity to MM168366
| Tanimoto metric | 0.6966 |
|---|---|
| Cosine metric | 0.8346 |
| Dice metric | 0.8212 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM374588
Similarity: 0.6667
Similarity to MM374588
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8025 |
| Dice metric | 0.8 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM258943
Similarity: 0.6634
Similarity to MM258943
| Tanimoto metric | 0.6634 |
|---|---|
| Cosine metric | 0.799 |
| Dice metric | 0.7976 |
| MW: | 149.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+151 more
