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DocumentationIdentifier: MM386065
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM386065 |
| SMILES |
CCOC(CF)CNC=O
|
| InChIKey |
PPSQZSXUNGWBMV-UHFFFAOYSA-N
|
| MW [Da] |
149.17
Automatically obtained from RDkit software. |
| LogP |
0.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM198669
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Similarity to MM198669
| Tanimoto metric | 0.8198 |
|---|---|
| Cosine metric | 0.9054 |
| Dice metric | 0.901 |
| MW: | 135.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM355533
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Similarity to MM355533
| Tanimoto metric | 0.7227 |
|---|---|
| Cosine metric | 0.8419 |
| Dice metric | 0.839 |
| MW: | 149.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM386449
Similarity: 0.6815
Similarity to MM386449
| Tanimoto metric | 0.6815 |
|---|---|
| Cosine metric | 0.8108 |
| Dice metric | 0.8106 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+166 more
