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DocumentationIdentifier: MM258743
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM258743 |
| SMILES |
CC(F)CNCC(F)=CF
|
| InChIKey |
PLZCNVZBZRSSDA-UHFFFAOYSA-N
|
| MW [Da] |
153.15
Automatically obtained from RDkit software. |
| LogP |
1.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM167768
Similarity: 0.7204
Similarity to MM167768
| Tanimoto metric | 0.7204 |
|---|---|
| Cosine metric | 0.8488 |
| Dice metric | 0.8375 |
| MW: | 139.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM257763
Similarity: 0.6606
Similarity to MM257763
| Tanimoto metric | 0.6606 |
|---|---|
| Cosine metric | 0.7959 |
| Dice metric | 0.7956 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM374464
Similarity: 0.623
Similarity to MM374464
| Tanimoto metric | 0.623 |
|---|---|
| Cosine metric | 0.7691 |
| Dice metric | 0.7677 |
| MW: | 149.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+159 more
