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DocumentationIdentifier: MM357076
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM357076 |
| SMILES |
CC=CNC(=O)CC=CF
|
| InChIKey |
GRBIQOWKKJUTLT-UHFFFAOYSA-N
|
| MW [Da] |
143.16
Automatically obtained from RDkit software. |
| LogP |
1.51
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156946
Similarity: 0.8058
Similarity to MM156946
| Tanimoto metric | 0.8058 |
|---|---|
| Cosine metric | 0.8977 |
| Dice metric | 0.8925 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM280322
Similarity: 0.7411
Similarity to MM280322
| Tanimoto metric | 0.7411 |
|---|---|
| Cosine metric | 0.8526 |
| Dice metric | 0.8513 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253292
Similarity: 0.7311
Similarity to MM253292
| Tanimoto metric | 0.7311 |
|---|---|
| Cosine metric | 0.8447 |
| Dice metric | 0.8447 |
| MW: | 147.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+367 more
