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DocumentationIdentifier: MM386399
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM386399 |
| SMILES |
C=CCC(CF)CNC=N
|
| InChIKey |
JTULTVODUBAQRL-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
1.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM392375
Similarity: 0.6695
Similarity to MM392375
| Tanimoto metric | 0.6695 |
|---|---|
| Cosine metric | 0.8025 |
| Dice metric | 0.802 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM155935
Similarity: 0.6667
Similarity to MM155935
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8165 |
| Dice metric | 0.8 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM385979
Similarity: 0.6393
Similarity to MM385979
| Tanimoto metric | 0.6393 |
|---|---|
| Cosine metric | 0.7802 |
| Dice metric | 0.78 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+191 more
