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DocumentationIdentifier: MM333201
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM333201 |
| SMILES |
CCNC(C=O)C(F)F
|
| InChIKey |
WUMSEGFXFLESOE-UHFFFAOYSA-N
|
| MW [Da] |
137.13
Automatically obtained from RDkit software. |
| LogP |
0.43
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM308214
Similarity: 0.7963
Similarity to MM308214
| Tanimoto metric | 0.7963 |
|---|---|
| Cosine metric | 0.8924 |
| Dice metric | 0.8866 |
| MW: | 148.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM49029
Similarity: 0.7907
Similarity to MM49029
| Tanimoto metric | 0.7907 |
|---|---|
| Cosine metric | 0.8892 |
| Dice metric | 0.8831 |
| MW: | 123.1 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM304824
Similarity: 0.6187
Similarity to MM304824
| Tanimoto metric | 0.6187 |
|---|---|
| Cosine metric | 0.7866 |
| Dice metric | 0.7644 |
| MW: | 151.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+135 more
